2-phenyl-N-pyridin-2-ylbutanamide

C15H16N2O — CID 2852795

IUPAC2-phenyl-N-pyridin-2-ylbutanamide
SMILESCCC(C(=O)Nc1ccccn1)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-2-13(12-8-4-3-5-9-12)15(18)17-14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,16,17,18)
InChIKeyQUXZVSPEGBUMBE-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.21
Rot. Bonds4

About 2-phenyl-N-pyridin-2-ylbutanamide

2-phenyl-N-pyridin-2-ylbutanamide (PubChem CID 2852795) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-phenyl-N-pyridin-2-ylbutanamide.

Molecular Properties

Compound Name2-phenyl-N-pyridin-2-ylbutanamide
PubChem CID2852795
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-phenyl-N-pyridin-2-ylbutanamide
SMILESCCC(C(=O)Nc1ccccn1)c1ccccc1
InChIInChI=1S/C15H16N2O/c1-2-13(12-8-4-3-5-9-12)15(18)17-14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,16,17,18)
InChIKeyQUXZVSPEGBUMBE-UHFFFAOYSA-N
XLogP3.21
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-phenyl-N-pyridin-2-ylbutanamide 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 2-phenyl-N-pyridin-2-ylbutanamide?
The IUPAC name of 2-phenyl-N-pyridin-2-ylbutanamide (CID 2852795) is 2-phenyl-N-pyridin-2-ylbutanamide.
What is the SMILES notation for 2-phenyl-N-pyridin-2-ylbutanamide?
The canonical SMILES for 2-phenyl-N-pyridin-2-ylbutanamide is CCC(C(=O)Nc1ccccn1)c1ccccc1.
What is the InChIKey of 2-phenyl-N-pyridin-2-ylbutanamide?
The InChIKey is QUXZVSPEGBUMBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-2-13(12-8-4-3-5-9-12)15(18)17-14-10-6-7-11-16-14/h3-11,13H,2H2,1H3,(H,16,17,18).
What are the key properties of 2-phenyl-N-pyridin-2-ylbutanamide?
2-phenyl-N-pyridin-2-ylbutanamide has a molecular weight of 240.31 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-pyridin-2-ylbutanamide is sourced from PubChem (CID 2852795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).