N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

C23H26N2O2 — CID 86899515

IUPACN-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESO=C1CCc2cc(C(=O)NC(Cc3ccccc3)C3CCCC3)ccc2N1
InChIInChI=1S/C23H26N2O2/c26-22-13-11-18-15-19(10-12-20(18)24-22)23(27)25-21(17-8-4-5-9-17)14-16-6-2-1-3-7-16/h1-3,6-7,10,12,15,17,21H,4-5,8-9,11,13-14H2,(H,24,26)(H,25,27)
InChIKeyPVSFIRUJBWAJMW-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.10
Rot. Bonds5

About N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide

N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (PubChem CID 86899515) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
PubChem CID86899515
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC NameN-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESO=C1CCc2cc(C(=O)NC(Cc3ccccc3)C3CCCC3)ccc2N1
InChIInChI=1S/C23H26N2O2/c26-22-13-11-18-15-19(10-12-20(18)24-22)23(27)25-21(17-8-4-5-9-17)14-16-6-2-1-3-7-16/h1-3,6-7,10,12,15,17,21H,4-5,8-9,11,13-14H2,(H,24,26)(H,25,27)
InChIKeyPVSFIRUJBWAJMW-UHFFFAOYSA-N
XLogP4.10
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1,2-diphenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 46564543
N-[(4-benzylcyclohexyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 58923659
3-cyclopropyl-3-[(2-oxo-1,3-dihydroindole-5-carbonyl)amino]propanoic acid
CID 102710846
(2S)-3-hydroxy-2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]propanoic acid
CID 102710665
N-(2-methyl-1-phenylpropyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 24625536
2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]acetic acid
CID 82480129
2-oxo-N-(1-piperidin-3-ylethyl)-3,4-dihydro-1H-quinoline-6-carboxamide;hydrochloride
CID 119474020
N-[2-(cycloheptylamino)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 119619891
N-(4-hydroxycyclohexyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 103605870
3-(1H-indol-3-yl)-2-[(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)amino]propanoic acid
CID 119201550
N-cyclopentyl-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxamide
CID 39896851
N-(1-naphthalen-1-ylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 86911762

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The IUPAC name of N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide (CID 86899515) is N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide.
What is the SMILES notation for N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The canonical SMILES for N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is O=C1CCc2cc(C(=O)NC(Cc3ccccc3)C3CCCC3)ccc2N1.
What is the InChIKey of N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
The InChIKey is PVSFIRUJBWAJMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c26-22-13-11-18-15-19(10-12-20(18)24-22)23(27)25-21(17-8-4-5-9-17)14-16-6-2-1-3-7-16/h1-3,6-7,10,12,15,17,21H,4-5,8-9,11,13-14H2,(H,24,26)(H,25,27).
What are the key properties of N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide?
N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide has a molecular weight of 362.47 g/mol, XLogP of 4.10, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentyl-2-phenylethyl)-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide is sourced from PubChem (CID 86899515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).