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N,2-dimethyl-2-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-amine
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ChemBase ID:
128290
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Molecular Formular:
C16H18N2
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Molecular Mass:
238.32752
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Monoisotopic Mass:
238.14699859
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SMILES and InChIs
SMILES:
CNC1Cc2c(cccc2)N(C)c2ccccc12
Canonical SMILES:
CNC1Cc2ccccc2N(c2c1cccc2)C
InChI:
InChI=1S/C16H18N2/c1-17-14-11-12-7-3-5-9-15(12)18(2)16-10-6-4-8-13(14)16/h3-10,14,17H,11H2,1-2H3
InChIKey:
YXVZOBVWVRFPTE-UHFFFAOYSA-N
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Cite this record
CBID:128290 http://www.chembase.cn/molecule-128290.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N,2-dimethyl-2-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-9-amine
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N,2-dimethyl-2-azatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-amine
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IUPAC Traditional name
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metapramine
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N,2-dimethyl-2-azatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-amine
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Synonyms
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10,11-Dihydro-N,5-dimethyl-5H-Dibenz[b,f]azepin-10-amine
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5-Methyl-10-methylamino-10,11-dihydrodibenzo[b,f]azepine
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Metapramine
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RP 19560
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10,11-Dihydro-5-methyl-10-5H-Dibenz[b,f]azepine
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Metapramine
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CAS Number
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PubChem SID
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PubChem CID
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Chemspider ID
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Unique Ingredient Identifier
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Wikipedia Title
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
H Acceptors
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2
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H Donor
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1
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LogD (pH = 5.5)
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0.1552892
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LogD (pH = 7.4)
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1.3929796
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Log P
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3.294852
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Molar Refractivity
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75.6687 cm3
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Polarizability
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29.205658 Å3
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Polar Surface Area
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15.27 Å2
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Rotatable Bonds
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1
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
Wikipedia
TRC
Toronto Research Chemicals -
M225830
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Metapramine is a tricyclic antidepressant derived from dibenzoazepine. Metapramine acts as a norepinephrine reuptake inhibitor without affecting the reuptake of serotonin or dopamine. |
PATENTS
PATENTS
PubChem Patent
Google Patent