N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide

C19H17ClN2O3 — CID 26210631

IUPACN-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide
SMILESCOc1cc(OC)c(NC(=O)c2cc(C)nc3ccccc23)cc1Cl
InChIInChI=1S/C19H17ClN2O3/c1-11-8-13(12-6-4-5-7-15(12)21-11)19(23)22-16-9-14(20)17(24-2)10-18(16)25-3/h4-10H,1-3H3,(H,22,23)
InChIKeyGVYZZXHSWKFQFT-UHFFFAOYSA-N
MW356.81 g/mol
LogP4.47
Rot. Bonds4

About N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide

N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide (PubChem CID 26210631) has the molecular formula C19H17ClN2O3 and a molecular weight of 356.81 g/mol. Its IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide
PubChem CID26210631
Molecular FormulaC19H17ClN2O3
Molecular Weight356.81 g/mol
Exact Mass356.09
IUPAC NameN-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide
SMILESCOc1cc(OC)c(NC(=O)c2cc(C)nc3ccccc23)cc1Cl
InChIInChI=1S/C19H17ClN2O3/c1-11-8-13(12-6-4-5-7-15(12)21-11)19(23)22-16-9-14(20)17(24-2)10-18(16)25-3/h4-10H,1-3H3,(H,22,23)
InChIKeyGVYZZXHSWKFQFT-UHFFFAOYSA-N
XLogP4.47
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.81
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorophenyl)-2-methylquinoline-4-carboxamide
CID 856039
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2-chlorophenyl)quinoline-4-carboxamide
CID 2164864
N-(5-chloro-2,4-dimethoxyphenyl)naphthalene-1-carboxamide
CID 823910
N-(4-chloro-2-methoxy-5-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 1328482
N-(4-chloro-2,5-dimethoxyphenyl)quinoline-4-carboxamide
CID 78813029
N-(2-chloro-4-fluorophenyl)-2-methylquinoline-4-carboxamide
CID 26364307
N-(5-chloro-2,4-dimethoxyphenyl)-2-hydroxybenzamide
CID 772092
N-(5-chloro-2,4-dimethoxyphenyl)benzamide
CID 835257
sodium 3-[(5-chloro-2,4-dimethoxyphenyl)carbamoyl]naphthalen-2-olate
CID 23668732
N-(2-methylquinolin-4-yl)-2-(3,4,5-trimethoxyphenyl)quinoline-4-carboxamide
CID 3900592
N-(5-chloro-2,4-dimethoxyphenyl)-2-fluorobenzamide
CID 836294
N-(5-chloro-2,4-dimethoxyphenyl)-3-(4-methylphenyl)cinnoline-4-carboxamide
CID 46287876

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide?
The IUPAC name of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide (CID 26210631) is N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide.
What is the SMILES notation for N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide?
The canonical SMILES for N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide is COc1cc(OC)c(NC(=O)c2cc(C)nc3ccccc23)cc1Cl.
What is the InChIKey of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide?
The InChIKey is GVYZZXHSWKFQFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3/c1-11-8-13(12-6-4-5-7-15(12)21-11)19(23)22-16-9-14(20)17(24-2)10-18(16)25-3/h4-10H,1-3H3,(H,22,23).
What are the key properties of N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide?
N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide has a molecular weight of 356.81 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2,4-dimethoxyphenyl)-2-methylquinoline-4-carboxamide is sourced from PubChem (CID 26210631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).