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MFCD00019275 molecular structure
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N-cyclopentylcyclopentanamine

ChemBase ID: 262294
Molecular Formular: C10H19N
Molecular Mass: 153.26456
Monoisotopic Mass: 153.15174961
SMILES and InChIs

SMILES:
N(C1CCCC1)C1CCCC1
Canonical SMILES:
C1CCC(C1)NC1CCCC1
InChI:
InChI=1S/C10H19N/c1-2-6-9(5-1)11-10-7-3-4-8-10/h9-11H,1-8H2
InChIKey:
FUUUBHCENZGYJA-UHFFFAOYSA-N

Cite this record

CBID:262294 http://www.chembase.cn/molecule-262294.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-cyclopentylcyclopentanamine
IUPAC Traditional name
N-cyclopentylcyclopentanamine
Synonyms
N-cyclopentylcyclopentanamine
MDL Number
MFCD00019275
PubChem SID
164318204
PubChem CID
247671

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Enamine
EN300-52499 external link Add to cart Please log in.
Data Source Data ID
PubChem 247671 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.72303843  LogD (pH = 7.4) -0.5639206 
Log P 2.5165253  Molar Refractivity 47.5198 cm3
Polarizability 19.244478 Å3 Polar Surface Area 12.03 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Product Information Bioassay(PubChem)
Hydrophobicity(logP)
2.426 expand Show data source
Purity
95% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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