N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide

C17H13ClN2O2 — CID 2111763

IUPACN-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C17H13ClN2O2/c1-22-16-9-7-12(18)10-15(16)20-17(21)14-8-6-11-4-2-3-5-13(11)19-14/h2-10H,1H3,(H,20,21)
InChIKeyWFIYNPXRCAJGTQ-UHFFFAOYSA-N
MW312.76 g/mol
LogP4.15
Rot. Bonds3

About N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide

N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide (PubChem CID 2111763) has the molecular formula C17H13ClN2O2 and a molecular weight of 312.76 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
PubChem CID2111763
Molecular FormulaC17H13ClN2O2
Molecular Weight312.76 g/mol
Exact Mass312.07
IUPAC NameN-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc2ccccc2n1
InChIInChI=1S/C17H13ClN2O2/c1-22-16-9-7-12(18)10-15(16)20-17(21)14-8-6-11-4-2-3-5-13(11)19-14/h2-10H,1H3,(H,20,21)
InChIKeyWFIYNPXRCAJGTQ-UHFFFAOYSA-N
XLogP4.15
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.76
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4,5-dimethoxy-2-(quinoline-2-carbonylamino)phenyl]quinoline-2-carboxamide
CID 91594053
N-(5-chloro-2-methoxyphenyl)-6-methoxyquinoline-2-carboxamide
CID 33314112
[(2S)-1-(5-chloro-2-methoxyanilino)-1-oxopropan-2-yl] quinoline-2-carboxylate
CID 2630739
N-(4-chloro-2-iodophenyl)quinoline-2-carboxamide
CID 107640561
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]quinoline-2-carboxamide
CID 3265897
6-N-(5-chloro-2-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099986
N-(5-chloro-2-methoxyphenyl)-6-fluoropyridine-2-carboxamide
CID 113323350
N-(5-chloro-2-methoxyphenyl)-2-quinolin-2-ylsulfanylacetamide
CID 7755341
tert-butyl N-[2-methoxy-5-(quinoline-2-carbonylamino)phenyl]carbamate
CID 55654804
N-(3,4,5-trimethoxyphenyl)quinoline-2-carboxamide
CID 17410358
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methoxyphenyl)quinoline-2-carboxamide
CID 122323135
6-N-(5-chloro-2-methoxyphenyl)-2-N-(2-methoxyethyl)pyridine-2,6-dicarboxamide
CID 109095751

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide (CID 2111763) is N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide is COc1ccc(Cl)cc1NC(=O)c1ccc2ccccc2n1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide?
The InChIKey is WFIYNPXRCAJGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O2/c1-22-16-9-7-12(18)10-15(16)20-17(21)14-8-6-11-4-2-3-5-13(11)19-14/h2-10H,1H3,(H,20,21).
What are the key properties of N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide?
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide has a molecular weight of 312.76 g/mol, XLogP of 4.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide is sourced from PubChem (CID 2111763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).