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1-cyclopentyl-N-(9H-fluoren-9-yl)-6-oxopiperidine-3-carboxamide

ChemBase ID: 322978
Molecular Formular: C24H26N2O2
Molecular Mass: 374.47544
Monoisotopic Mass: 374.19942808
SMILES and InChIs

SMILES:
C1(NC(=O)C2CN(C(=O)CC2)C2CCCC2)c2c(c3c1cccc3)cccc2
Canonical SMILES:
O=C(C1CCC(=O)N(C1)C1CCCC1)NC1c2ccccc2c2c1cccc2
InChI:
InChI=1S/C24H26N2O2/c27-22-14-13-16(15-26(22)17-7-1-2-8-17)24(28)25-23-20-11-5-3-9-18(20)19-10-4-6-12-21(19)23/h3-6,9-12,16-17,23H,1-2,7-8,13-15H2,(H,25,28)
InChIKey:
IVDBUHURPZAZSD-UHFFFAOYSA-N

Cite this record

CBID:322978 http://www.chembase.cn/molecule-322978.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
1-cyclopentyl-N-(9H-fluoren-9-yl)-6-oxopiperidine-3-carboxamide
IUPAC Traditional name
1-cyclopentyl-N-(9H-fluoren-9-yl)-6-oxopiperidine-3-carboxamide
Synonyms
1-cyclopentyl-N-9H-fluoren-9-yl-6-oxo-3-piperidinecarboxamide

DATA SOURCES

DATA SOURCES

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Data Source Data ID
ChemBridge 11367646 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem 供应商提供(Chembridge)
Acid pKa 13.434707  H Acceptors
H Donor LogD (pH = 5.5) 3.4214153 
LogD (pH = 7.4) 3.4214153  Log P 3.4214156 
Molar Refractivity 108.9472 cm3 Polarizability 43.62003 Å3
Polar Surface Area 49.41 Å2 Rotatable Bonds
Lipinski's Rule of Five true 
H Acceptors H Donor
Log P 3.68  LOG S -5.23 
Polar Surface Area 49.41 Å2 Rotatable Bonds

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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