4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide

C15H17N3O — CID 81236792

IUPAC4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)NC(C)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-11(12-6-4-3-5-7-12)18-15(19)13-10-17-9-8-14(13)16-2/h3-11H,1-2H3,(H,16,17)(H,18,19)
InChIKeyWUIBDHWWYYCUCC-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.61
Rot. Bonds4

About 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide

4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide (PubChem CID 81236792) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide
PubChem CID81236792
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide
SMILESCNc1ccncc1C(=O)NC(C)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-11(12-6-4-3-5-7-12)18-15(19)13-10-17-9-8-14(13)16-2/h3-11H,1-2H3,(H,16,17)(H,18,19)
InChIKeyWUIBDHWWYYCUCC-UHFFFAOYSA-N
XLogP2.61
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-phenylethyl]pyridine-4-carboxamide
CID 730033
N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-4-(methylamino)pyridine-3-carboxamide
CID 81242851
N-[1-(dimethylamino)propan-2-yl]-4-(methylamino)pyridine-3-carboxamide
CID 82949883
2-hydroxy-N-(1-pyridin-3-ylethyl)benzamide
CID 43419974
N-heptan-2-yl-4-(methylamino)pyridine-3-carboxamide
CID 81240356
N-[4-(dimethylamino)butan-2-yl]-4-(methylamino)pyridine-3-carboxamide
CID 81239916
3-(3-aminoprop-1-ynyl)-N-(1-phenylethyl)pyridine-4-carboxamide
CID 66483662
2-[2,6-bis(1-phenylethylcarbamoyl)phenyl]-1-N,3-N-bis(1-phenylethyl)benzene-1,3-dicarboxamide
CID 570721
3-hydroxy-N-(1-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 81443089
2-hydrazinyl-N-(1-phenylethyl)benzamide
CID 62248479
2-fluoro-N-[(1S)-1-pyridin-4-ylethyl]benzamide
CID 40585288
N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-(methylamino)benzamide
CID 81368855

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide (CID 81236792) is 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide is CNc1ccncc1C(=O)NC(C)c1ccccc1.
What is the InChIKey of 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide?
The InChIKey is WUIBDHWWYYCUCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-11(12-6-4-3-5-7-12)18-15(19)13-10-17-9-8-14(13)16-2/h3-11H,1-2H3,(H,16,17)(H,18,19).
What are the key properties of 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide?
4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-(1-phenylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81236792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).