N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide

C13H14N2O3 — CID 113221314

IUPACN-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCCc2ccco2)cc1=O
InChIInChI=1S/C13H14N2O3/c1-15-7-5-10(9-12(15)16)13(17)14-6-4-11-3-2-8-18-11/h2-3,5,7-9H,4,6H2,1H3,(H,14,17)
InChIKeyXGDBMEAIBAKZMA-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.95
Rot. Bonds4

About N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 113221314) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID113221314
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC NameN-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCCc2ccco2)cc1=O
InChIInChI=1S/C13H14N2O3/c1-15-7-5-10(9-12(15)16)13(17)14-6-4-11-3-2-8-18-11/h2-3,5,7-9H,4,6H2,1H3,(H,14,17)
InChIKeyXGDBMEAIBAKZMA-UHFFFAOYSA-N
XLogP0.95
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-1-methyl-2-oxopyridine-4-carboxamide
CID 35555679
N-[2-(furan-2-yl)ethyl]-4-methylbenzamide
CID 5305680
5-[2-(furan-2-yl)ethylcarbamoyl]furan-3-carboxylic acid
CID 104607308
N-[2-(furan-2-yl)ethyl]-2H-benzotriazole-5-carboxamide
CID 18126076
3-ethyl-N-[2-(furan-2-yl)ethyl]-2,4-dioxo-1H-quinazoline-7-carboxamide
CID 47051903
5-bromo-N-[2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 65309421
N-[2-(furan-2-yl)ethyl]-3-(3-hydroxyprop-1-ynyl)-4-methylbenzamide
CID 81460232
2-[2-[(1-methyl-2-oxopyridine-4-carbonyl)amino]ethyl]-1,3-thiazole-4-carboxylic acid
CID 66375242
3-amino-4,5-dichloro-N-[2-(furan-2-yl)ethyl]benzamide
CID 61139466
N-[2-(furan-2-yl)ethyl]-2-(propan-2-ylamino)pyrimidine-5-carboxamide
CID 74233042
N-[2-[ethyl(propyl)amino]ethyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103719329
1-methyl-N-(3-methyl-2-oxobutyl)-2-oxopyridine-4-carboxamide
CID 104860744

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 113221314) is N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)NCCc2ccco2)cc1=O.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is XGDBMEAIBAKZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-15-7-5-10(9-12(15)16)13(17)14-6-4-11-3-2-8-18-11/h2-3,5,7-9H,4,6H2,1H3,(H,14,17).
What are the key properties of N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 113221314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).