N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide

C17H13ClN2O — CID 142343740

IUPACN-(4-chloro-2-methylphenyl)quinoline-7-carboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1ccc2cccnc2c1
InChIInChI=1S/C17H13ClN2O/c1-11-9-14(18)6-7-15(11)20-17(21)13-5-4-12-3-2-8-19-16(12)10-13/h2-10H,1H3,(H,20,21)
InChIKeyHAHYPUYVCFXDNA-UHFFFAOYSA-N
MW296.76 g/mol
LogP4.45
Rot. Bonds2

About N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide

N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide (PubChem CID 142343740) has the molecular formula C17H13ClN2O and a molecular weight of 296.76 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)quinoline-7-carboxamide
PubChem CID142343740
Molecular FormulaC17H13ClN2O
Molecular Weight296.76 g/mol
Exact Mass296.07
IUPAC NameN-(4-chloro-2-methylphenyl)quinoline-7-carboxamide
SMILESCc1cc(Cl)ccc1NC(=O)c1ccc2cccnc2c1
InChIInChI=1S/C17H13ClN2O/c1-11-9-14(18)6-7-15(11)20-17(21)13-5-4-12-3-2-8-19-16(12)10-13/h2-10H,1H3,(H,20,21)
InChIKeyHAHYPUYVCFXDNA-UHFFFAOYSA-N
XLogP4.45
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.76
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-benzamido-4-methylphenyl)quinoline-7-carboxamide
CID 58842913
N-(3,4-dichlorophenyl)quinoline-7-carboxamide
CID 142343714
N-(4-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 18148116
N-(4-bromo-2-methylphenyl)quinoline-6-carboxamide
CID 62044989
N-[4-fluoro-3-(methylsulfamoyl)phenyl]quinoline-7-carboxamide
CID 142343698
4-chloro-N-[4-[(4-chlorobenzoyl)amino]-3-methylphenyl]benzamide
CID 27042156
N-(4-chloro-2-methylphenyl)-2-methoxypyridine-4-carboxamide
CID 110859208
1-(4-chloro-2-methylphenyl)-3-quinolin-8-ylurea
CID 108991844
N-(4-chloro-2-methylphenyl)-4-phenylbenzamide
CID 19174130
N-(3-chlorophenyl)-6-methylquinoline-7-carboxamide
CID 142343847
N-(4-benzamido-3-methylphenyl)-4-chlorobenzamide
CID 1365594
N-(4-chloro-2-methylphenyl)-3-fluorobenzamide
CID 2671206

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide (CID 142343740) is N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide is Cc1cc(Cl)ccc1NC(=O)c1ccc2cccnc2c1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide?
The InChIKey is HAHYPUYVCFXDNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O/c1-11-9-14(18)6-7-15(11)20-17(21)13-5-4-12-3-2-8-19-16(12)10-13/h2-10H,1H3,(H,20,21).
What are the key properties of N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide?
N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide has a molecular weight of 296.76 g/mol, XLogP of 4.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)quinoline-7-carboxamide is sourced from PubChem (CID 142343740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).