N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide

C15H14N2O3 — CID 89174231

IUPACN-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide
SMILESCC(COc1cc(C(=O)N=O)ccn1)c1ccccc1
InChIInChI=1S/C15H14N2O3/c1-11(12-5-3-2-4-6-12)10-20-14-9-13(7-8-16-14)15(18)17-19/h2-9,11H,10H2,1H3
InChIKeyWUVYAEWTONGIKO-UHFFFAOYSA-N
MW270.29 g/mol
LogP3.17
Rot. Bonds5

About N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide

N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide (PubChem CID 89174231) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide
PubChem CID89174231
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide
SMILESCC(COc1cc(C(=O)N=O)ccn1)c1ccccc1
InChIInChI=1S/C15H14N2O3/c1-11(12-5-3-2-4-6-12)10-20-14-9-13(7-8-16-14)15(18)17-19/h2-9,11H,10H2,1H3
InChIKeyWUVYAEWTONGIKO-UHFFFAOYSA-N
XLogP3.17
TPSA68.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide?
The IUPAC name of N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide (CID 89174231) is N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide.
What is the SMILES notation for N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide?
The canonical SMILES for N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide is CC(COc1cc(C(=O)N=O)ccn1)c1ccccc1.
What is the InChIKey of N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide?
The InChIKey is WUVYAEWTONGIKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-11(12-5-3-2-4-6-12)10-20-14-9-13(7-8-16-14)15(18)17-19/h2-9,11H,10H2,1H3.
What are the key properties of N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide?
N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 3.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-oxo-2-(2-phenylpropoxy)pyridine-4-carboxamide is sourced from PubChem (CID 89174231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).