8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide

C17H13FN2O — CID 110489296

IUPAC8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide
SMILESCc1cc(C(=O)Nc2ccccc2)c2cccc(F)c2n1
InChIInChI=1S/C17H13FN2O/c1-11-10-14(13-8-5-9-15(18)16(13)19-11)17(21)20-12-6-3-2-4-7-12/h2-10H,1H3,(H,20,21)
InChIKeyCYFIPOUAQNRLEA-UHFFFAOYSA-N
MW280.30 g/mol
LogP3.93
Rot. Bonds2

About 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide

8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide (PubChem CID 110489296) has the molecular formula C17H13FN2O and a molecular weight of 280.30 g/mol. Its IUPAC name is 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide.

Molecular Properties

Compound Name8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide
PubChem CID110489296
Molecular FormulaC17H13FN2O
Molecular Weight280.30 g/mol
Exact Mass280.10
IUPAC Name8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide
SMILESCc1cc(C(=O)Nc2ccccc2)c2cccc(F)c2n1
InChIInChI=1S/C17H13FN2O/c1-11-10-14(13-8-5-9-15(18)16(13)19-11)17(21)20-12-6-3-2-4-7-12/h2-10H,1H3,(H,20,21)
InChIKeyCYFIPOUAQNRLEA-UHFFFAOYSA-N
XLogP3.93
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-8-fluoro-2-methylquinoline-4-carboxamide
CID 110489287
8-fluoro-2-methyl-N-propylquinoline-4-carboxamide
CID 110489274
8-fluoro-2-methylquinoline-4-carboxylic acid;(8-fluoro-2-methylquinolin-4-yl)methanol
CID 159119849
N,N-diethyl-8-fluoro-2-methylquinoline-4-carboxamide
CID 110489286
2-methyl-N-[3-(trifluoromethoxy)phenyl]quinoline-4-carboxamide
CID 38258538
6-fluoro-N-(3-hydroxyphenyl)-2-methylquinoline-4-carboxamide
CID 108789542
N-[4-(2,6-difluorophenyl)-1,3-thiazol-2-yl]-2-methylquinoline-4-carboxamide
CID 39804997
N-(2-fluoro-4-methylphenyl)-2-methylquinoline-4-carboxamide
CID 17451783
N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide
CID 17434472
N-[4-[(4-anilino-6-methylpyrimidin-2-yl)amino]phenyl]-2-fluorobenzamide
CID 121032203
2-methyl-N-(3-sulfamoylphenyl)quinoline-4-carboxamide
CID 9413123
N-(5-amino-2-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 24698449

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide?
The IUPAC name of 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide (CID 110489296) is 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide.
What is the SMILES notation for 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide?
The canonical SMILES for 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide is Cc1cc(C(=O)Nc2ccccc2)c2cccc(F)c2n1.
What is the InChIKey of 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide?
The InChIKey is CYFIPOUAQNRLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O/c1-11-10-14(13-8-5-9-15(18)16(13)19-11)17(21)20-12-6-3-2-4-7-12/h2-10H,1H3,(H,20,21).
What are the key properties of 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide?
8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide has a molecular weight of 280.30 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-2-methyl-N-phenylquinoline-4-carboxamide is sourced from PubChem (CID 110489296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).