2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide

C16H19N3O — CID 63011141

IUPAC2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NC(C)Cc2ccccc2)ccn1
InChIInChI=1S/C16H19N3O/c1-12(10-13-6-4-3-5-7-13)19-16(20)14-8-9-18-15(11-14)17-2/h3-9,11-12H,10H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyZSRKVIQFZJALEX-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.48
Rot. Bonds5

About 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide

2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide (PubChem CID 63011141) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide
PubChem CID63011141
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NC(C)Cc2ccccc2)ccn1
InChIInChI=1S/C16H19N3O/c1-12(10-13-6-4-3-5-7-13)19-16(20)14-8-9-18-15(11-14)17-2/h3-9,11-12H,10H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyZSRKVIQFZJALEX-UHFFFAOYSA-N
XLogP2.48
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 ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)-N-(1-methylsulfonylpropan-2-yl)pyridine-4-carboxamide
CID 64643269
N-[1-(furan-2-yl)ethyl]-2-(methylamino)pyridine-4-carboxamide
CID 62168505
3,4-dimethoxy-N-(1-phenylpropan-2-yl)benzamide
CID 2843229
N-(1-phenylpropan-2-yl)-3H-benzimidazole-5-carboxamide
CID 63012845
3-fluoro-2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide
CID 105386176
N-(1-phenylpropan-2-yl)-1H-indazole-6-carboxamide
CID 63010618
2-hydrazinyl-N-(4-methylpentan-2-yl)pyridine-4-carboxamide
CID 62241746
N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide
CID 768448
2-(methylamino)-N-[1-oxo-1-(propylamino)propan-2-yl]pyridine-4-carboxamide
CID 55046580
3,4,5-trimethoxy-N-[(2R)-1-phenylpropan-2-yl]benzamide
CID 888468
4-fluoro-3-methyl-N-(1-phenylpropan-2-yl)benzamide
CID 63213334
N-(1-phenylpropan-2-yl)-4-sulfanylbenzamide
CID 107029231

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide (CID 63011141) is 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide is CNc1cc(C(=O)NC(C)Cc2ccccc2)ccn1.
What is the InChIKey of 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide?
The InChIKey is ZSRKVIQFZJALEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-12(10-13-6-4-3-5-7-13)19-16(20)14-8-9-18-15(11-14)17-2/h3-9,11-12H,10H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide?
2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(1-phenylpropan-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 63011141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).