N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide

C21H20ClN3O2 — CID 109190315

IUPACN-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
SMILESCOc1ccccc1CNc1ccc(C(=O)Nc2ccc(Cl)cc2C)nc1
InChIInChI=1S/C21H20ClN3O2/c1-14-11-16(22)7-9-18(14)25-21(26)19-10-8-17(13-24-19)23-12-15-5-3-4-6-20(15)27-2/h3-11,13,23H,12H2,1-2H3,(H,25,26)
InChIKeyAVHNZXFOENODPX-UHFFFAOYSA-N
MW381.86 g/mol
LogP4.92
Rot. Bonds6

About N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide

N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide (PubChem CID 109190315) has the molecular formula C21H20ClN3O2 and a molecular weight of 381.86 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
PubChem CID109190315
Molecular FormulaC21H20ClN3O2
Molecular Weight381.86 g/mol
Exact Mass381.12
IUPAC NameN-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
SMILESCOc1ccccc1CNc1ccc(C(=O)Nc2ccc(Cl)cc2C)nc1
InChIInChI=1S/C21H20ClN3O2/c1-14-11-16(22)7-9-18(14)25-21(26)19-10-8-17(13-24-19)23-12-15-5-3-4-6-20(15)27-2/h3-11,13,23H,12H2,1-2H3,(H,25,26)
InChIKeyAVHNZXFOENODPX-UHFFFAOYSA-N
XLogP4.92
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.86
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methylphenyl)-6-[(2-methoxyphenyl)methylamino]pyrimidine-4-carboxamide
CID 109348899
N-(2-fluorophenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190308
N-(2,5-dimethoxyphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109190329
5-[(2-chlorophenyl)methylamino]-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 109189944
N-(5-chloro-2-methylphenyl)-2-[(2-methoxyphenyl)methylamino]pyrimidine-4-carboxamide
CID 109306192
N-(4-chloro-2-methylphenyl)-5-(2-methylpropylamino)pyridine-2-carboxamide
CID 109181316
5-(tert-butylamino)-N-(4-chloro-2-methylphenyl)pyridine-2-carboxamide
CID 109195211
N-[(2-fluorophenyl)methyl]-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide
CID 109189345
5-[(2-fluorophenyl)methylamino]-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109189465
N-(3-chlorophenyl)-2-[(2-methoxyphenyl)methylamino]pyrimidine-5-carboxamide
CID 109257933
N-(3-chloro-4-fluorophenyl)-2-[(2-methoxyphenyl)methylamino]pyrimidine-5-carboxamide
CID 109257939
5-[(2-methoxyphenyl)methylamino]-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109190258

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide (CID 109190315) is N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide is COc1ccccc1CNc1ccc(C(=O)Nc2ccc(Cl)cc2C)nc1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide?
The InChIKey is AVHNZXFOENODPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClN3O2/c1-14-11-16(22)7-9-18(14)25-21(26)19-10-8-17(13-24-19)23-12-15-5-3-4-6-20(15)27-2/h3-11,13,23H,12H2,1-2H3,(H,25,26).
What are the key properties of N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide?
N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide has a molecular weight of 381.86 g/mol, XLogP of 4.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-5-[(2-methoxyphenyl)methylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109190315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).