3-phenyl-N-pyridin-3-ylpropanamide

C14H14N2O — CID 683950

IUPAC3-phenyl-N-pyridin-3-ylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccnc1
InChIInChI=1S/C14H14N2O/c17-14(16-13-7-4-10-15-11-13)9-8-12-5-2-1-3-6-12/h1-7,10-11H,8-9H2,(H,16,17)
InChIKeyVDIGXPJBFMIXHE-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.65
Rot. Bonds4

About 3-phenyl-N-pyridin-3-ylpropanamide

3-phenyl-N-pyridin-3-ylpropanamide (PubChem CID 683950) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 3-phenyl-N-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name3-phenyl-N-pyridin-3-ylpropanamide
PubChem CID683950
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name3-phenyl-N-pyridin-3-ylpropanamide
SMILESO=C(CCc1ccccc1)Nc1cccnc1
InChIInChI=1S/C14H14N2O/c17-14(16-13-7-4-10-15-11-13)9-8-12-5-2-1-3-6-12/h1-7,10-11H,8-9H2,(H,16,17)
InChIKeyVDIGXPJBFMIXHE-UHFFFAOYSA-N
XLogP2.65
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-pyridin-3-ylpropanamide?
The IUPAC name of 3-phenyl-N-pyridin-3-ylpropanamide (CID 683950) is 3-phenyl-N-pyridin-3-ylpropanamide.
What is the SMILES notation for 3-phenyl-N-pyridin-3-ylpropanamide?
The canonical SMILES for 3-phenyl-N-pyridin-3-ylpropanamide is O=C(CCc1ccccc1)Nc1cccnc1.
What is the InChIKey of 3-phenyl-N-pyridin-3-ylpropanamide?
The InChIKey is VDIGXPJBFMIXHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c17-14(16-13-7-4-10-15-11-13)9-8-12-5-2-1-3-6-12/h1-7,10-11H,8-9H2,(H,16,17).
What are the key properties of 3-phenyl-N-pyridin-3-ylpropanamide?
3-phenyl-N-pyridin-3-ylpropanamide has a molecular weight of 226.28 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-pyridin-3-ylpropanamide is sourced from PubChem (CID 683950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).