N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide

C24H19N3O2 — CID 58842913

IUPACN-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3cccnc3c2)cc1NC(=O)c1ccccc1
InChIInChI=1S/C24H19N3O2/c1-16-9-12-20(15-21(16)27-23(28)18-6-3-2-4-7-18)26-24(29)19-11-10-17-8-5-13-25-22(17)14-19/h2-15H,1H3,(H,26,29)(H,27,28)
InChIKeyQAYKDYPTQBJERW-UHFFFAOYSA-N
MW381.44 g/mol
LogP5.05
Rot. Bonds4

About N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide

N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide (PubChem CID 58842913) has the molecular formula C24H19N3O2 and a molecular weight of 381.44 g/mol. Its IUPAC name is N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide.

Molecular Properties

Compound NameN-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide
PubChem CID58842913
Molecular FormulaC24H19N3O2
Molecular Weight381.44 g/mol
Exact Mass381.15
IUPAC NameN-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3cccnc3c2)cc1NC(=O)c1ccccc1
InChIInChI=1S/C24H19N3O2/c1-16-9-12-20(15-21(16)27-23(28)18-6-3-2-4-7-18)26-24(29)19-11-10-17-8-5-13-25-22(17)14-19/h2-15H,1H3,(H,26,29)(H,27,28)
InChIKeyQAYKDYPTQBJERW-UHFFFAOYSA-N
XLogP5.05
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.44
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide
CID 18422129
N-(3-benzamido-4-methylphenyl)pyridine-3-carboxamide
CID 6486649
N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide
CID 142343740
N-quinolin-6-ylbenzamide
CID 833617
N-(3,4-dichlorophenyl)quinoline-7-carboxamide
CID 142343714
N-(5-benzamido-2-methylphenyl)-4-(chloromethyl)benzamide
CID 22291056
3-benzamido-4-methyl-N-(4-methyl-3-nitrophenyl)benzamide
CID 55633368
N-(4-phenylsulfinamoylphenyl)quinoline-7-carboxamide
CID 166899812
N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide
CID 86874562
N-[4-fluoro-3-(methylsulfamoyl)phenyl]quinoline-7-carboxamide
CID 142343698
3-benzamido-4-methyl-N-(2-quinolin-8-ylethyl)benzamide
CID 39316228
ethyl 2-fluoro-4-(quinoline-7-carbonylamino)benzoate
CID 68694892

Frequently Asked Questions

What is the IUPAC name of N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide?
The IUPAC name of N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide (CID 58842913) is N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide.
What is the SMILES notation for N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide?
The canonical SMILES for N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide is Cc1ccc(NC(=O)c2ccc3cccnc3c2)cc1NC(=O)c1ccccc1.
What is the InChIKey of N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide?
The InChIKey is QAYKDYPTQBJERW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O2/c1-16-9-12-20(15-21(16)27-23(28)18-6-3-2-4-7-18)26-24(29)19-11-10-17-8-5-13-25-22(17)14-19/h2-15H,1H3,(H,26,29)(H,27,28).
What are the key properties of N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide?
N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide has a molecular weight of 381.44 g/mol, XLogP of 5.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide is sourced from PubChem (CID 58842913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).