N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide

C24H19N3O3 — CID 18422129

IUPACN-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3ncccc3c2)cc1NC(=O)c1cccc(O)c1
InChIInChI=1S/C24H19N3O3/c1-15-7-9-19(14-22(15)27-24(30)17-4-2-6-20(28)13-17)26-23(29)18-8-10-21-16(12-18)5-3-11-25-21/h2-14,28H,1H3,(H,26,29)(H,27,30)
InChIKeyGZRYZXHLIBEEKG-UHFFFAOYSA-N
MW397.43 g/mol
LogP4.75
Rot. Bonds4

About N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide

N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide (PubChem CID 18422129) has the molecular formula C24H19N3O3 and a molecular weight of 397.43 g/mol. Its IUPAC name is N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide.

Molecular Properties

Compound NameN-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide
PubChem CID18422129
Molecular FormulaC24H19N3O3
Molecular Weight397.43 g/mol
Exact Mass397.14
IUPAC NameN-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide
SMILESCc1ccc(NC(=O)c2ccc3ncccc3c2)cc1NC(=O)c1cccc(O)c1
InChIInChI=1S/C24H19N3O3/c1-15-7-9-19(14-22(15)27-24(30)17-4-2-6-20(28)13-17)26-23(29)18-8-10-21-16(12-18)5-3-11-25-21/h2-14,28H,1H3,(H,26,29)(H,27,30)
InChIKeyGZRYZXHLIBEEKG-UHFFFAOYSA-N
XLogP4.75
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.43
LogP ≤ 54.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide
CID 58842913
N-(4-iodophenyl)quinoline-6-carboxamide
CID 60723213
N-pyridin-4-ylquinoline-6-carboxamide
CID 53313330
N-(4-ethoxy-3-methylphenyl)quinoline-6-carboxamide
CID 86874562
N-(4-bromo-2-methylphenyl)quinoline-6-carboxamide
CID 62044989
N-quinolin-6-ylbenzamide
CID 833617
N-quinolin-6-yl-3-sulfanylbenzamide
CID 107028522
N-(3-bromo-4-fluorophenyl)quinoline-6-carboxamide
CID 115661425
2-(methylamino)-N-quinolin-6-ylpyridine-4-carboxamide
CID 62640761
N-(3-amino-4-bromophenyl)quinoline-6-carboxamide
CID 79754299
N-[3-[(2,6-dimethylphenyl)sulfamoyl]-4-methoxyphenyl]quinoline-6-carboxamide
CID 156859982
N-quinolin-6-yl-2H-benzotriazole-5-carboxamide
CID 60555981

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide?
The IUPAC name of N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide (CID 18422129) is N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide.
What is the SMILES notation for N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide?
The canonical SMILES for N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide is Cc1ccc(NC(=O)c2ccc3ncccc3c2)cc1NC(=O)c1cccc(O)c1.
What is the InChIKey of N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide?
The InChIKey is GZRYZXHLIBEEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O3/c1-15-7-9-19(14-22(15)27-24(30)17-4-2-6-20(28)13-17)26-23(29)18-8-10-21-16(12-18)5-3-11-25-21/h2-14,28H,1H3,(H,26,29)(H,27,30).
What are the key properties of N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide?
N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide has a molecular weight of 397.43 g/mol, XLogP of 4.75, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-hydroxybenzoyl)amino]-4-methylphenyl]quinoline-6-carboxamide is sourced from PubChem (CID 18422129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).