N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide

C18H15FN2O — CID 17434472

IUPACN-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide
SMILESCc1ccc(F)c(NC(=O)c2cc(C)nc3ccccc23)c1
InChIInChI=1S/C18H15FN2O/c1-11-7-8-15(19)17(9-11)21-18(22)14-10-12(2)20-16-6-4-3-5-13(14)16/h3-10H,1-2H3,(H,21,22)
InChIKeyVSHHKHQVNOMIET-UHFFFAOYSA-N
MW294.33 g/mol
LogP4.24
Rot. Bonds2

About N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide

N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide (PubChem CID 17434472) has the molecular formula C18H15FN2O and a molecular weight of 294.33 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide
PubChem CID17434472
Molecular FormulaC18H15FN2O
Molecular Weight294.33 g/mol
Exact Mass294.12
IUPAC NameN-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide
SMILESCc1ccc(F)c(NC(=O)c2cc(C)nc3ccccc23)c1
InChIInChI=1S/C18H15FN2O/c1-11-7-8-15(19)17(9-11)21-18(22)14-10-12(2)20-16-6-4-3-5-13(14)16/h3-10H,1-2H3,(H,21,22)
InChIKeyVSHHKHQVNOMIET-UHFFFAOYSA-N
XLogP4.24
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluoro-4-methylphenyl)-2-methylquinoline-4-carboxamide
CID 17451783
N-(5-amino-2-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 24698449
N-(2-fluoro-5-methylphenyl)-2-propan-2-ylquinoline-4-carboxamide
CID 16562783
N-(2-amino-4-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 24710172
N-(2-chloro-4-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 26364307
N-(2-chlorophenyl)-2-methylquinoline-4-carboxamide
CID 856039
N-(4-chloro-2-fluorophenyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide
CID 3298781
N-(3,4-difluorophenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 1012287
N-(2-ethylsulfonylphenyl)-2-methylquinoline-4-carboxamide
CID 55613609
N-(4-chloro-2-fluorophenyl)-2-(3-methylphenyl)quinoline-4-carboxamide
CID 4196964
N-(2,4-dimethylphenyl)-2-phenylquinoline-4-carboxamide
CID 3480982
N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide
CID 62243099

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide (CID 17434472) is N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide is Cc1ccc(F)c(NC(=O)c2cc(C)nc3ccccc23)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide?
The InChIKey is VSHHKHQVNOMIET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O/c1-11-7-8-15(19)17(9-11)21-18(22)14-10-12(2)20-16-6-4-3-5-13(14)16/h3-10H,1-2H3,(H,21,22).
What are the key properties of N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide?
N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide has a molecular weight of 294.33 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-2-methylquinoline-4-carboxamide is sourced from PubChem (CID 17434472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).