6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide

C21H20ClN3O2 — CID 109156807

IUPAC6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)nc1
InChIInChI=1S/C21H20ClN3O2/c1-14-7-9-19(27-2)18(11-14)25-21(26)16-8-10-20(24-13-16)23-12-15-5-3-4-6-17(15)22/h3-11,13H,12H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyIWTDVXXMPQFMEI-UHFFFAOYSA-N
MW381.86 g/mol
LogP4.92
Rot. Bonds6

About 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide

6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 109156807) has the molecular formula C21H20ClN3O2 and a molecular weight of 381.86 g/mol. Its IUPAC name is 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
PubChem CID109156807
Molecular FormulaC21H20ClN3O2
Molecular Weight381.86 g/mol
Exact Mass381.12
IUPAC Name6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)nc1
InChIInChI=1S/C21H20ClN3O2/c1-14-7-9-19(27-2)18(11-14)25-21(26)16-8-10-20(24-13-16)23-12-15-5-3-4-6-17(15)22/h3-11,13H,12H2,1-2H3,(H,23,24)(H,25,26)
InChIKeyIWTDVXXMPQFMEI-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-(5-chloro-2-methoxyphenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155689
6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)-2-methylpyrimidine-4-carboxamide
CID 109369995
6-[(2-chlorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109156789
N-(2-chlorophenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155684
N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]-3,4-dimethoxybenzamide
CID 113027190
6-(2-ethoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109164093
6-(2,4-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109162546
N-(5-chloro-2-methoxyphenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 62171907
N-(4-chloro-2,5-dimethoxyphenyl)-6-(pyridin-2-ylmethylamino)pyridine-3-carboxamide
CID 109157742
6-[2-(4-fluorophenyl)ethylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109158658
N-(2-fluorophenyl)-6-[(2-methoxyphenyl)methylamino]pyridine-3-carboxamide
CID 109157086
6-(2-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109163334

Frequently Asked Questions

What is the IUPAC name of 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (CID 109156807) is 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is COc1ccc(C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)nc1.
What is the InChIKey of 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is IWTDVXXMPQFMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClN3O2/c1-14-7-9-19(27-2)18(11-14)25-21(26)16-8-10-20(24-13-16)23-12-15-5-3-4-6-17(15)22/h3-11,13H,12H2,1-2H3,(H,23,24)(H,25,26).
What are the key properties of 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)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 6-[(2-chlorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109156807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).