N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

C13H14N2O3 — CID 95976314

IUPACN-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N[C@@H](C)c2ccco2)c(=O)[nH]1
InChIInChI=1S/C13H14N2O3/c1-8-5-6-10(12(16)14-8)13(17)15-9(2)11-4-3-7-18-11/h3-7,9H,1-2H3,(H,14,16)(H,15,17)/t9-/m0/s1
InChIKeyPZXUGRFNLFJZKZ-VIFPVBQESA-N
MW246.27 g/mol
LogP1.77
Rot. Bonds3

About N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide

N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 95976314) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
PubChem CID95976314
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC NameN-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(C(=O)N[C@@H](C)c2ccco2)c(=O)[nH]1
InChIInChI=1S/C13H14N2O3/c1-8-5-6-10(12(16)14-8)13(17)15-9(2)11-4-3-7-18-11/h3-7,9H,1-2H3,(H,14,16)(H,15,17)/t9-/m0/s1
InChIKeyPZXUGRFNLFJZKZ-VIFPVBQESA-N
XLogP1.77
TPSA75.10 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(furan-2-yl)ethyl]-2-oxo-1H-pyridine-3-carboxamide
CID 18116946
N-[(1S)-1-(furan-2-yl)ethyl]-2-(methylamino)benzamide
CID 81399463
6-methyl-2-oxo-N-[(1S)-1-pyridin-2-ylethyl]-1H-pyridine-3-carboxamide
CID 95976232
N-(4-hydroxypentan-2-yl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 113384178
2-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 18116836
N-[(2S,3R)-4-hydroxy-3-methylbutan-2-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 97005058
2-(ethylamino)-N-[1-(furan-2-yl)ethyl]benzamide
CID 62169362
2-bromo-N-[1-(furan-2-yl)ethyl]-5-methylbenzamide
CID 80966287
4-amino-2-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 43535392
N-[1-(furan-2-yl)ethyl]acetamide
CID 22460009
N-[1-(furan-2-yl)ethyl]-1H-indole-4-carboxamide
CID 43581973
N-[bis(4-hydroxyphenyl)methyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 155464294

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide (CID 95976314) is N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(C(=O)N[C@@H](C)c2ccco2)c(=O)[nH]1.
What is the InChIKey of N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is PZXUGRFNLFJZKZ-VIFPVBQESA-N. The full InChI is InChI=1S/C13H14N2O3/c1-8-5-6-10(12(16)14-8)13(17)15-9(2)11-4-3-7-18-11/h3-7,9H,1-2H3,(H,14,16)(H,15,17)/t9-/m0/s1.
What are the key properties of N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide?
N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(furan-2-yl)ethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 95976314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).