3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide

C24H21N3O2 — CID 140531580

IUPAC3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide
SMILESCc1c(-c2ccccc2)nc2ccccc2c1C(=O)NC(C)c1ccc[nH]c1=O
InChIInChI=1S/C24H21N3O2/c1-15-21(24(29)26-16(2)18-12-8-14-25-23(18)28)19-11-6-7-13-20(19)27-22(15)17-9-4-3-5-10-17/h3-14,16H,1-2H3,(H,25,28)(H,26,29)
InChIKeyIIMAPIMZPDMVDL-UHFFFAOYSA-N
MW383.45 g/mol
LogP4.39
Rot. Bonds4

About 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide

3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide (PubChem CID 140531580) has the molecular formula C24H21N3O2 and a molecular weight of 383.45 g/mol. Its IUPAC name is 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide
PubChem CID140531580
Molecular FormulaC24H21N3O2
Molecular Weight383.45 g/mol
Exact Mass383.16
IUPAC Name3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide
SMILESCc1c(-c2ccccc2)nc2ccccc2c1C(=O)NC(C)c1ccc[nH]c1=O
InChIInChI=1S/C24H21N3O2/c1-15-21(24(29)26-16(2)18-12-8-14-25-23(18)28)19-11-6-7-13-20(19)27-22(15)17-9-4-3-5-10-17/h3-14,16H,1-2H3,(H,25,28)(H,26,29)
InChIKeyIIMAPIMZPDMVDL-UHFFFAOYSA-N
XLogP4.39
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-N-[1-(2-oxo-1H-pyridin-3-yl)propyl]-2-phenylquinoline-4-carboxamide
CID 140531561
N-tert-butyl-3-methyl-2-phenylquinoline-4-carboxamide
CID 3639952
2-(4-methoxyphenyl)-3-methyl-N-propan-2-ylquinoline-4-carboxamide
CID 896971
3-methyl-2-phenylquinoline-4-carboxylic acid;hydrochloride
CID 140991456
3-methyl-N-[3-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]phenyl]-2-phenylquinoline-4-carboxamide
CID 3540473
N-(2,6-diethylphenyl)-3-methyl-2-phenylquinoline-4-carboxamide
CID 3417174
3-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenylquinoline-4-carboxamide
CID 4079544
N-cyclooctyl-3-methyl-2-phenylquinoline-4-carboxamide
CID 4122728
3-methyl-2-(4-methylphenyl)-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)quinoline-4-carboxamide
CID 4292288
N-(diaminomethylidene)-3-methyl-2-phenylquinoline-4-carboxamide
CID 54166006
ethyl 2-[(3-methyl-2-phenylquinoline-4-carbonyl)amino]acetate
CID 4525423
3-methyl-2-phenyl-8-propan-2-ylquinoline-4-carboxylic acid
CID 174865670

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide?
The IUPAC name of 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide (CID 140531580) is 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide.
What is the SMILES notation for 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide?
The canonical SMILES for 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide is Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)NC(C)c1ccc[nH]c1=O.
What is the InChIKey of 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide?
The InChIKey is IIMAPIMZPDMVDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2/c1-15-21(24(29)26-16(2)18-12-8-14-25-23(18)28)19-11-6-7-13-20(19)27-22(15)17-9-4-3-5-10-17/h3-14,16H,1-2H3,(H,25,28)(H,26,29).
What are the key properties of 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide?
3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide has a molecular weight of 383.45 g/mol, XLogP of 4.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[1-(2-oxo-1H-pyridin-3-yl)ethyl]-2-phenylquinoline-4-carboxamide is sourced from PubChem (CID 140531580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).