N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide

C21H20ClN3O2 — CID 109155689

IUPACN-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(NCc2ccccc2C)nc1
InChIInChI=1S/C21H20ClN3O2/c1-14-5-3-4-6-15(14)12-23-20-10-7-16(13-24-20)21(26)25-18-11-17(22)8-9-19(18)27-2/h3-11,13H,12H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyDFKXITOJGWKSFI-UHFFFAOYSA-N
MW381.86 g/mol
LogP4.92
Rot. Bonds6

About N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide

N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide (PubChem CID 109155689) has the molecular formula C21H20ClN3O2 and a molecular weight of 381.86 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
PubChem CID109155689
Molecular FormulaC21H20ClN3O2
Molecular Weight381.86 g/mol
Exact Mass381.12
IUPAC NameN-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1ccc(NCc2ccccc2C)nc1
InChIInChI=1S/C21H20ClN3O2/c1-14-5-3-4-6-15(14)12-23-20-10-7-16(13-24-20)21(26)25-18-11-17(22)8-9-19(18)27-2/h3-11,13H,12H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyDFKXITOJGWKSFI-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

6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109156807
N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 62171907
N-(5-chloro-2-methoxyphenyl)-6-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109156639
6-(2-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109163334
N-(5-chloro-2-methoxyphenyl)-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 109163811
N-(2-chlorophenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155684
6-[(2-chlorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109156789
N-(3-chloro-4-fluorophenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155687
6-[(3,4-dimethoxyphenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109159891
N-(2-fluorophenyl)-6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109157086
N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109255747
N-(5-chloro-2-methoxyphenyl)-6-[(2-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109120023

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide (CID 109155689) is N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide is COc1ccc(Cl)cc1NC(=O)c1ccc(NCc2ccccc2C)nc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is DFKXITOJGWKSFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClN3O2/c1-14-5-3-4-6-15(14)12-23-20-10-7-16(13-24-20)21(26)25-18-11-17(22)8-9-19(18)27-2/h3-11,13H,12H2,1-2H3,(H,23,24)(H,25,26).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-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-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109155689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).