5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide

C16H19N3O — CID 104641105

IUPAC5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)NCCc2cccc(C)c2)nc1
InChIInChI=1S/C16H19N3O/c1-12-4-3-5-13(10-12)8-9-18-16(20)15-7-6-14(17-2)11-19-15/h3-7,10-11,17H,8-9H2,1-2H3,(H,18,20)
InChIKeyYWUIVAUMSODDBK-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.40
Rot. Bonds5

About 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide

5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide (PubChem CID 104641105) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide
PubChem CID104641105
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide
SMILESCNc1ccc(C(=O)NCCc2cccc(C)c2)nc1
InChIInChI=1S/C16H19N3O/c1-12-4-3-5-13(10-12)8-9-18-16(20)15-7-6-14(17-2)11-19-15/h3-7,10-11,17H,8-9H2,1-2H3,(H,18,20)
InChIKeyYWUIVAUMSODDBK-UHFFFAOYSA-N
XLogP2.40
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylphenyl)methyl]-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109188383
N-[2-(4-hydroxyphenyl)ethyl]-5-(methylamino)pyridine-2-carboxamide
CID 104640447
5-(methylamino)-N-(2-pyridin-4-ylethyl)pyridine-2-carboxamide
CID 104640377
N-[2-(3-chlorophenyl)ethyl]-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179720
5-(4-methylanilino)-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide
CID 109188420
5-chloro-6-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 62312710
N-[2-(furan-2-yl)ethyl]-5-(methylamino)pyridine-2-carboxamide
CID 113436120
5-(3,4-dimethylanilino)-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109191782
5-(2,6-dimethylanilino)-N-[(3-methylphenyl)methyl]pyridine-2-carboxamide
CID 109188428
5-(methylamino)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]pyridine-2-carboxamide
CID 104641287
N-[(4-fluorophenyl)methyl]-5-[(3-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109188488
N-[2-(3-chlorophenyl)ethyl]-5-(prop-2-enylamino)pyridine-2-carboxamide
CID 109180508

Frequently Asked Questions

What is the IUPAC name of 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide (CID 104641105) is 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide is CNc1ccc(C(=O)NCCc2cccc(C)c2)nc1.
What is the InChIKey of 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is YWUIVAUMSODDBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-12-4-3-5-13(10-12)8-9-18-16(20)15-7-6-14(17-2)11-19-15/h3-7,10-11,17H,8-9H2,1-2H3,(H,18,20).
What are the key properties of 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide?
5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methylamino)-N-[2-(3-methylphenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 104641105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).