N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide

C19H24N2O2 — CID 110331062

IUPACN-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
SMILESCc1cccc2cc(CCC(=O)NC3CCCCC3)c(=O)[nH]c12
InChIInChI=1S/C19H24N2O2/c1-13-6-5-7-14-12-15(19(23)21-18(13)14)10-11-17(22)20-16-8-3-2-4-9-16/h5-7,12,16H,2-4,8-11H2,1H3,(H,20,22)(H,21,23)
InChIKeyZIUOCNBEKUFOKD-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.22
Rot. Bonds4

About N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide

N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide (PubChem CID 110331062) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
PubChem CID110331062
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
SMILESCc1cccc2cc(CCC(=O)NC3CCCCC3)c(=O)[nH]c12
InChIInChI=1S/C19H24N2O2/c1-13-6-5-7-14-12-15(19(23)21-18(13)14)10-11-17(22)20-16-8-3-2-4-9-16/h5-7,12,16H,2-4,8-11H2,1H3,(H,20,22)(H,21,23)
InChIKeyZIUOCNBEKUFOKD-UHFFFAOYSA-N
XLogP3.22
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331054
1-cyclohexyl-3-[2-(8-methyl-2-oxo-1H-quinolin-3-yl)ethyl]urea
CID 110325752
N-cyclopentyl-3-(6,8-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331527
N-tert-butyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331121
3-cyclohexyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2R)-oxolan-2-yl]methyl]urea
CID 1138180
N-cyclohexyl-N-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 769064
N-cyclopentyl-3-(7-fluoro-2-oxo-1H-quinolin-3-yl)propanamide
CID 110407034
3-cyclohexyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-[[(2S)-oxolan-2-yl]methyl]thiourea
CID 1157151
N-[(2-fluorophenyl)methyl]-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331083
8-methyl-3-[3-(4-methylpiperazin-1-yl)-3-oxopropyl]-1H-quinolin-2-one
CID 110331072
3-cyclohexyl-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-1-(3-morpholin-4-ylpropyl)urea
CID 1138169
N-cycloheptyl-3-(3-methyl-2-oxo-1H-quinolin-6-yl)propanamide
CID 110390127

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide?
The IUPAC name of N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide (CID 110331062) is N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide?
The canonical SMILES for N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide is Cc1cccc2cc(CCC(=O)NC3CCCCC3)c(=O)[nH]c12.
What is the InChIKey of N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide?
The InChIKey is ZIUOCNBEKUFOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-13-6-5-7-14-12-15(19(23)21-18(13)14)10-11-17(22)20-16-8-3-2-4-9-16/h5-7,12,16H,2-4,8-11H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide?
N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide has a molecular weight of 312.41 g/mol, XLogP of 3.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide is sourced from PubChem (CID 110331062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).