N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide

C15H14N2O3 — CID 105063564

IUPACN-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cccc(C(C)=O)c1
InChIInChI=1S/C15H14N2O3/c1-10(18)11-4-3-5-12(8-11)17-15(19)13-6-7-16-9-14(13)20-2/h3-9H,1-2H3,(H,17,19)
InChIKeyKFLAMUSTLZYOJU-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.55
Rot. Bonds4

About N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide

N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide (PubChem CID 105063564) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide
PubChem CID105063564
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC NameN-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide
SMILESCOc1cnccc1C(=O)Nc1cccc(C(C)=O)c1
InChIInChI=1S/C15H14N2O3/c1-10(18)11-4-3-5-12(8-11)17-15(19)13-6-7-16-9-14(13)20-2/h3-9H,1-2H3,(H,17,19)
InChIKeyKFLAMUSTLZYOJU-UHFFFAOYSA-N
XLogP2.55
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide (CID 105063564) is N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide is COc1cnccc1C(=O)Nc1cccc(C(C)=O)c1.
What is the InChIKey of N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide?
The InChIKey is KFLAMUSTLZYOJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-10(18)11-4-3-5-12(8-11)17-15(19)13-6-7-16-9-14(13)20-2/h3-9H,1-2H3,(H,17,19).
What are the key properties of N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide?
N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-3-methoxypyridine-4-carboxamide is sourced from PubChem (CID 105063564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).