5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide

C15H17N3O — CID 81317136

IUPAC5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
SMILESCC(Cc1ccccc1)NC(=O)c1ccc(N)cn1
InChIInChI=1S/C15H17N3O/c1-11(9-12-5-3-2-4-6-12)18-15(19)14-8-7-13(16)10-17-14/h2-8,10-11H,9,16H2,1H3,(H,18,19)
InChIKeyZOIABJQWBCVOFW-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.02
Rot. Bonds4

About 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide

5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide (PubChem CID 81317136) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
PubChem CID81317136
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide
SMILESCC(Cc1ccccc1)NC(=O)c1ccc(N)cn1
InChIInChI=1S/C15H17N3O/c1-11(9-12-5-3-2-4-6-12)18-15(19)14-8-7-13(16)10-17-14/h2-8,10-11H,9,16H2,1H3,(H,18,19)
InChIKeyZOIABJQWBCVOFW-UHFFFAOYSA-N
XLogP2.02
TPSA68.01 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 ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide (CID 81317136) is 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide is CC(Cc1ccccc1)NC(=O)c1ccc(N)cn1.
What is the InChIKey of 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
The InChIKey is ZOIABJQWBCVOFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-11(9-12-5-3-2-4-6-12)18-15(19)14-8-7-13(16)10-17-14/h2-8,10-11H,9,16H2,1H3,(H,18,19).
What are the key properties of 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide?
5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(1-phenylpropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 81317136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).