N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide

C19H16F2N2O2 — CID 110680300

IUPACN-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCc1cc2ccccc2n(CCC(=O)Nc2ccc(F)c(F)c2)c1=O
InChIInChI=1S/C19H16F2N2O2/c1-12-10-13-4-2-3-5-17(13)23(19(12)25)9-8-18(24)22-14-6-7-15(20)16(21)11-14/h2-7,10-11H,8-9H2,1H3,(H,22,24)
InChIKeyJKTAMTDZYAVQGI-UHFFFAOYSA-N
MW342.35 g/mol
LogP3.62
Rot. Bonds4

About N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide

N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide (PubChem CID 110680300) has the molecular formula C19H16F2N2O2 and a molecular weight of 342.35 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
PubChem CID110680300
Molecular FormulaC19H16F2N2O2
Molecular Weight342.35 g/mol
Exact Mass342.12
IUPAC NameN-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCc1cc2ccccc2n(CCC(=O)Nc2ccc(F)c(F)c2)c1=O
InChIInChI=1S/C19H16F2N2O2/c1-12-10-13-4-2-3-5-17(13)23(19(12)25)9-8-18(24)22-14-6-7-15(20)16(21)11-14/h2-7,10-11H,8-9H2,1H3,(H,22,24)
InChIKeyJKTAMTDZYAVQGI-UHFFFAOYSA-N
XLogP3.62
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680283
N-(3-methoxyphenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680279
N-(3,4-difluorophenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
CID 767803
3-(3-methyl-2-oxoquinolin-1-yl)-N-pyrimidin-2-ylpropanamide
CID 110680287
2-(3-methyl-2-oxoquinolin-1-yl)-N-(4-methylphenyl)acetamide
CID 110680370
N-(3,4-difluorophenyl)-3-pyrrol-1-ylpropanamide
CID 110688754
N,N'-bis(3,4-difluorophenyl)butanediamide
CID 896186
N-(4-acetylphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
CID 110680389
N-(3,4-difluorophenyl)-3-[1-(4-fluorophenyl)-6-methyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl]propanamide
CID 16882628
N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680260
N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
CID 110688906
N-(3,4-dimethylphenyl)-3-(2-oxo-1,3-benzothiazol-3-yl)propanamide
CID 767815

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
The IUPAC name of N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide (CID 110680300) is N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
The canonical SMILES for N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide is Cc1cc2ccccc2n(CCC(=O)Nc2ccc(F)c(F)c2)c1=O.
What is the InChIKey of N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
The InChIKey is JKTAMTDZYAVQGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O2/c1-12-10-13-4-2-3-5-17(13)23(19(12)25)9-8-18(24)22-14-6-7-15(20)16(21)11-14/h2-7,10-11H,8-9H2,1H3,(H,22,24).
What are the key properties of N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide has a molecular weight of 342.35 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide is sourced from PubChem (CID 110680300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).