N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide

C15H16N2O2 — CID 55169382

IUPACN-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
SMILESO=C(NC(CO)Cc1ccccc1)c1ccccn1
InChIInChI=1S/C15H16N2O2/c18-11-13(10-12-6-2-1-3-7-12)17-15(19)14-8-4-5-9-16-14/h1-9,13,18H,10-11H2,(H,17,19)
InChIKeyQWFOIDOFNYSCQC-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.41
Rot. Bonds5

About N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide

N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide (PubChem CID 55169382) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
PubChem CID55169382
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
SMILESO=C(NC(CO)Cc1ccccc1)c1ccccn1
InChIInChI=1S/C15H16N2O2/c18-11-13(10-12-6-2-1-3-7-12)17-15(19)14-8-4-5-9-16-14/h1-9,13,18H,10-11H2,(H,17,19)
InChIKeyQWFOIDOFNYSCQC-UHFFFAOYSA-N
XLogP1.41
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide (CID 55169382) is N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide is O=C(NC(CO)Cc1ccccc1)c1ccccn1.
What is the InChIKey of N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide?
The InChIKey is QWFOIDOFNYSCQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c18-11-13(10-12-6-2-1-3-7-12)17-15(19)14-8-4-5-9-16-14/h1-9,13,18H,10-11H2,(H,17,19).
What are the key properties of N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide?
N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 55169382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).