N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide

C15H15N3O2 — CID 139000795

IUPACN-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide
SMILESCC(NC(=O)c1ccncc1)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H15N3O2/c1-15(14(16)20,12-5-3-2-4-6-12)18-13(19)11-7-9-17-10-8-11/h2-10H,1H3,(H2,16,20)(H,18,19)
InChIKeyIUUBNJJLZBNSNC-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.21
Rot. Bonds4

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

N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide (PubChem CID 139000795) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide
PubChem CID139000795
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide
SMILESCC(NC(=O)c1ccncc1)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H15N3O2/c1-15(14(16)20,12-5-3-2-4-6-12)18-13(19)11-7-9-17-10-8-11/h2-10H,1H3,(H2,16,20)(H,18,19)
InChIKeyIUUBNJJLZBNSNC-UHFFFAOYSA-N
XLogP1.21
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-benzamido-2-phenylpropanoic acid
CID 10967539
N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-1,6-naphthyridine-4-carboxamide
CID 99787443
N-[(2S)-3-oxo-2-phenylbutan-2-yl]benzamide
CID 101078744
N-[(2S)-1-amino-1-oxo-2-phenylpropan-2-yl]isoquinoline-1-carboxamide
CID 96523163
2-(benzylamino)-2-pyridin-4-ylpropanamide
CID 54891502
N-(1-amino-1-oxo-2-phenylpropan-2-yl)-5-bromopyridine-2-carboxamide
CID 122156320
N-[1-amino-2-(3-chlorophenyl)-1-oxopropan-2-yl]-2-fluoropyridine-4-carboxamide
CID 71862054
N-(2-pyridin-2-ylpropan-2-yl)pyridine-4-carboxamide
CID 110870482
N-[(2R)-1-amino-1-oxo-2-phenylpropan-2-yl]-2-methoxy-5-methylbenzamide
CID 97236307
3,3,3-trifluoro-2-methyl-2-(pyridine-4-carbonylamino)propanoic acid
CID 79795224
(2S)-2-(carbamoylamino)-2-phenylpropanoic acid
CID 94456492
2-[[2-(5-methyl-1,3-thiazol-2-yl)acetyl]amino]-2-phenylpropanamide
CID 138996384

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide?
The IUPAC name of N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide (CID 139000795) is N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide is CC(NC(=O)c1ccncc1)(C(N)=O)c1ccccc1.
What is the InChIKey of N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide?
The InChIKey is IUUBNJJLZBNSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-15(14(16)20,12-5-3-2-4-6-12)18-13(19)11-7-9-17-10-8-11/h2-10H,1H3,(H2,16,20)(H,18,19).
What are the key properties of N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide?
N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-1-oxo-2-phenylpropan-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 139000795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).