N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide

C24H26N2O2 — CID 4908379

IUPACN-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide
SMILESCc1cccc(-c2c(NC(=O)C3CCCCC3)n(C)c3ccccc3c2=O)c1
InChIInChI=1S/C24H26N2O2/c1-16-9-8-12-18(15-16)21-22(27)19-13-6-7-14-20(19)26(2)23(21)25-24(28)17-10-4-3-5-11-17/h6-9,12-15,17H,3-5,10-11H2,1-2H3,(H,25,28)
InChIKeyQZBDYDMRJSJUMF-UHFFFAOYSA-N
MW374.48 g/mol
LogP5.03
Rot. Bonds3

About N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide

N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide (PubChem CID 4908379) has the molecular formula C24H26N2O2 and a molecular weight of 374.48 g/mol. Its IUPAC name is N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide
PubChem CID4908379
Molecular FormulaC24H26N2O2
Molecular Weight374.48 g/mol
Exact Mass374.20
IUPAC NameN-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide
SMILESCc1cccc(-c2c(NC(=O)C3CCCCC3)n(C)c3ccccc3c2=O)c1
InChIInChI=1S/C24H26N2O2/c1-16-9-8-12-18(15-16)21-22(27)19-13-6-7-14-20(19)26(2)23(21)25-24(28)17-10-4-3-5-11-17/h6-9,12-15,17H,3-5,10-11H2,1-2H3,(H,25,28)
InChIKeyQZBDYDMRJSJUMF-UHFFFAOYSA-N
XLogP5.03
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.48
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(8-methyl-4-oxo-3-phenylchromen-2-yl)cyclohexanecarboxamide
CID 16957079
2-chloro-N-[1-methyl-4-oxo-3-[3-(trifluoromethyl)phenyl]quinolin-2-yl]benzamide
CID 4910543
N-[3-(3-methoxyphenyl)-1-methyl-4-oxoquinolin-2-yl]-2-methylbenzamide
CID 4901307
N-[6-(3-methylphenyl)-1H-indazol-3-yl]cyclohexanecarboxamide
CID 69065843
2-chloro-N-[3-(3,4-dichlorophenyl)-1-methyl-4-oxoquinolin-2-yl]benzamide
CID 4911005
N-[2-(3-methylphenyl)-4-oxochromen-6-yl]cyclohexanecarboxamide
CID 18568688
N-[3-(3-methoxyphenyl)-1-methyl-4-oxoquinolin-2-yl]pentanamide
CID 4870056
N-[3-(3-methoxyphenyl)-1-methyl-4-oxoquinolin-2-yl]-3-nitrobenzamide
CID 4903800
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)cyclohexanecarboxamide
CID 40656282
1-(1-methyl-2-oxoquinoline-4-carbonyl)-N-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 55809832
3-(cyclopropanecarbonylamino)-1-methylindole-2-carboxylic acid
CID 155961141
N-[(3-methylphenyl)methyl]cyclopentanecarboxamide
CID 39985159

Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide (CID 4908379) is N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide is Cc1cccc(-c2c(NC(=O)C3CCCCC3)n(C)c3ccccc3c2=O)c1.
What is the InChIKey of N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide?
The InChIKey is QZBDYDMRJSJUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O2/c1-16-9-8-12-18(15-16)21-22(27)19-13-6-7-14-20(19)26(2)23(21)25-24(28)17-10-4-3-5-11-17/h6-9,12-15,17H,3-5,10-11H2,1-2H3,(H,25,28).
What are the key properties of N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide?
N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide has a molecular weight of 374.48 g/mol, XLogP of 5.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-3-(3-methylphenyl)-4-oxoquinolin-2-yl]cyclohexanecarboxamide is sourced from PubChem (CID 4908379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).