N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide

C22H24N2O4 — CID 169413733

IUPACN-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide
SMILESCOc1cc(C2CC(=O)Nc3cc(NC(=O)C4CCCC4)ccc32)ccc1O
InChIInChI=1S/C22H24N2O4/c1-28-20-10-14(6-9-19(20)25)17-12-21(26)24-18-11-15(7-8-16(17)18)23-22(27)13-4-2-3-5-13/h6-11,13,17,25H,2-5,12H2,1H3,(H,23,27)(H,24,26)
InChIKeyPWFUSBRTYFVBFI-UHFFFAOYSA-N
MW380.44 g/mol
LogP4.00
Rot. Bonds4

About N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide

N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide (PubChem CID 169413733) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide
PubChem CID169413733
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC NameN-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide
SMILESCOc1cc(C2CC(=O)Nc3cc(NC(=O)C4CCCC4)ccc32)ccc1O
InChIInChI=1S/C22H24N2O4/c1-28-20-10-14(6-9-19(20)25)17-12-21(26)24-18-11-15(7-8-16(17)18)23-22(27)13-4-2-3-5-13/h6-11,13,17,25H,2-5,12H2,1H3,(H,23,27)(H,24,26)
InChIKeyPWFUSBRTYFVBFI-UHFFFAOYSA-N
XLogP4.00
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 54.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide with MolForge

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Related Compounds

N-[4-(1,3-benzodioxol-4-yl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide
CID 169419293
methyl N-[4-[4-(2-aminoethyl)phenyl]-2-oxo-3,4-dihydro-1H-quinolin-7-yl]carbamate
CID 170512777
N-(3-bromo-4-methoxyphenyl)cyclopentanecarboxamide
CID 110776805
methyl N-[4-[4-(4-methylpiperazin-1-yl)phenyl]-2-oxo-3,4-dihydro-1H-quinolin-7-yl]carbamate
CID 169421884
ethyl N-[(4R)-4-(3-fluoro-4-methylphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]carbamate
CID 95123061
(4S)-7-hydroxy-4-(4-methoxyphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 95166951
N-(4-acetamido-3-methoxyphenyl)cyclohexanecarboxamide
CID 53491142
N-(3-amino-4-methoxyphenyl)cyclooctanecarboxamide
CID 65023208
methyl 5-[(4R)-7-ethoxy-2-oxo-3,4-dihydro-1H-quinolin-4-yl]-2-hydroxybenzoate
CID 95127709
2,5-bis(4-hydroxy-3-methoxyphenyl)cyclopentan-1-one
CID 100938571
methyl 4-(4-hydroxy-3-methoxyphenyl)-7-methyl-2,5-dioxo-1,3,4,6,7,8-hexahydroquinoline-6-carboxylate
CID 3239250
N-(4-chloro-3-hydroxyphenyl)cyclooctanecarboxamide
CID 65023340

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide?
The IUPAC name of N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide (CID 169413733) is N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide is COc1cc(C2CC(=O)Nc3cc(NC(=O)C4CCCC4)ccc32)ccc1O.
What is the InChIKey of N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide?
The InChIKey is PWFUSBRTYFVBFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-28-20-10-14(6-9-19(20)25)17-12-21(26)24-18-11-15(7-8-16(17)18)23-22(27)13-4-2-3-5-13/h6-11,13,17,25H,2-5,12H2,1H3,(H,23,27)(H,24,26).
What are the key properties of N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide?
N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide has a molecular weight of 380.44 g/mol, XLogP of 4.00, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-hydroxy-3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinolin-7-yl]cyclopentanecarboxamide is sourced from PubChem (CID 169413733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).