3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide

C24H28N2O2 — CID 18143095

IUPAC3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide
SMILESO=C(CCC1Cc2ccccc2NC1=O)NCC1(c2ccccc2)CCCC1
InChIInChI=1S/C24H28N2O2/c27-22(13-12-19-16-18-8-4-5-11-21(18)26-23(19)28)25-17-24(14-6-7-15-24)20-9-2-1-3-10-20/h1-5,8-11,19H,6-7,12-17H2,(H,25,27)(H,26,28)
InChIKeyVWUFIMBRSCQRLY-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.21
Rot. Bonds6

About 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide

3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide (PubChem CID 18143095) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide
PubChem CID18143095
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC Name3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide
SMILESO=C(CCC1Cc2ccccc2NC1=O)NCC1(c2ccccc2)CCCC1
InChIInChI=1S/C24H28N2O2/c27-22(13-12-19-16-18-8-4-5-11-21(18)26-23(19)28)25-17-24(14-6-7-15-24)20-9-2-1-3-10-20/h1-5,8-11,19H,6-7,12-17H2,(H,25,27)(H,26,28)
InChIKeyVWUFIMBRSCQRLY-UHFFFAOYSA-N
XLogP4.21
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxyethyl)-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 78839484
N-(2-aminoethyl)-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide;hydrochloride
CID 119383150
N-(3-hydroxypropyl)-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 78854593
methyl 2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]acetate
CID 134051213
2-[1-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]cyclobutyl]acetic acid
CID 119218020
3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
CID 24633457
N-[2-(cycloheptylamino)ethyl]-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 119619916
N-[(2-fluorophenyl)methyl]-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 16621979
N-(2-amino-2-ethylbutyl)-3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanamide
CID 119641050
cis-(1S,3R)-3-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 120675455
(2R)-2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]-2-phenylacetic acid
CID 119367609
2-[2-[3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)propanoylamino]phenyl]acetic acid
CID 119218504

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide?
The IUPAC name of 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide (CID 18143095) is 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide.
What is the SMILES notation for 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide?
The canonical SMILES for 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide is O=C(CCC1Cc2ccccc2NC1=O)NCC1(c2ccccc2)CCCC1.
What is the InChIKey of 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide?
The InChIKey is VWUFIMBRSCQRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c27-22(13-12-19-16-18-8-4-5-11-21(18)26-23(19)28)25-17-24(14-6-7-15-24)20-9-2-1-3-10-20/h1-5,8-11,19H,6-7,12-17H2,(H,25,27)(H,26,28).
What are the key properties of 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide?
3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide has a molecular weight of 376.50 g/mol, XLogP of 4.21, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxo-3,4-dihydro-1H-quinolin-3-yl)-N-[(1-phenylcyclopentyl)methyl]propanamide is sourced from PubChem (CID 18143095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).