2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide

C14H14N2O3 — CID 103762674

IUPAC2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide
SMILESO=C(NCCOc1ccccc1)c1cc[nH]c(=O)c1
InChIInChI=1S/C14H14N2O3/c17-13-10-11(6-7-15-13)14(18)16-8-9-19-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,15,17)(H,16,18)
InChIKeyKESWNOMJALDAGJ-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.18
Rot. Bonds5

About 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide

2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide (PubChem CID 103762674) has the molecular formula C14H14N2O3 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide
PubChem CID103762674
Molecular FormulaC14H14N2O3
Molecular Weight258.28 g/mol
Exact Mass258.10
IUPAC Name2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide
SMILESO=C(NCCOc1ccccc1)c1cc[nH]c(=O)c1
InChIInChI=1S/C14H14N2O3/c17-13-10-11(6-7-15-13)14(18)16-8-9-19-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,15,17)(H,16,18)
InChIKeyKESWNOMJALDAGJ-UHFFFAOYSA-N
XLogP1.18
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[3-(1-methylpyrazol-4-yl)phenoxy]ethyl]-2-oxo-1H-pyridine-4-carboxamide
CID 90740732
6-methoxy-N-(2-phenoxyethyl)naphthalene-2-carboxamide
CID 5302937
3-amino-N-(3-phenoxypropyl)benzamide
CID 62074463
4-amino-3,5-difluoro-N-(2-phenoxyethyl)benzamide
CID 63185424
N-(2-chloro-2-phenylethyl)-2-oxo-1H-pyridine-4-carboxamide
CID 114039911
4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide
CID 100543454
2-chloro-N-(2-phenoxyethyl)quinoline-6-carboxamide
CID 55730969
3,5-dibromo-N-(3-phenoxypropyl)benzamide
CID 107980421
N-[2-(4-aminophenoxy)ethyl]benzamide
CID 14121577
3-amino-5-nitro-N-(2-phenoxyethyl)benzamide
CID 143923153
N-[(3-methoxyphenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762651
2-oxo-N-(4,4,4-trifluorobutyl)-1H-pyridine-4-carboxamide
CID 103766068

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide?
The IUPAC name of 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide (CID 103762674) is 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide.
What is the SMILES notation for 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide?
The canonical SMILES for 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide is O=C(NCCOc1ccccc1)c1cc[nH]c(=O)c1.
What is the InChIKey of 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide?
The InChIKey is KESWNOMJALDAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3/c17-13-10-11(6-7-15-13)14(18)16-8-9-19-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,15,17)(H,16,18).
What are the key properties of 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide?
2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(2-phenoxyethyl)-1H-pyridine-4-carboxamide is sourced from PubChem (CID 103762674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).