1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide

C11H14N2O3 — CID 47099759

IUPAC1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCNC(=O)C1CC(=O)N(Cc2ccco2)C1
InChIInChI=1S/C11H14N2O3/c1-12-11(15)8-5-10(14)13(6-8)7-9-3-2-4-16-9/h2-4,8H,5-7H2,1H3,(H,12,15)
InChIKeyPFZFGVXQXYRQSJ-UHFFFAOYSA-N
MW222.24 g/mol
LogP0.37
Rot. Bonds3

About 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide

1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide (PubChem CID 47099759) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
PubChem CID47099759
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide
SMILESCNC(=O)C1CC(=O)N(Cc2ccco2)C1
InChIInChI=1S/C11H14N2O3/c1-12-11(15)8-5-10(14)13(6-8)7-9-3-2-4-16-9/h2-4,8H,5-7H2,1H3,(H,12,15)
InChIKeyPFZFGVXQXYRQSJ-UHFFFAOYSA-N
XLogP0.37
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (3S)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxylate
CID 42579834
N-cyclopentyl-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 47100703
1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl chloride
CID 50873925
N-(3,5-dimethylphenyl)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 42909280
N-(2,6-dichlorophenyl)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 113183148
(3R)-1-(furan-2-ylmethyl)-N-(4-hydroxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 39314628
N'-(furan-2-carbonyl)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbohydrazide
CID 17232608
methyl 2-[[(3R)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl]amino]-2-methylpropanoate
CID 94094042
N-(3-acetamidophenyl)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 51149894
N-[[[1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carbonyl]amino]carbamothioyl]acetamide
CID 17232816
(3R)-N-(4-fluorophenyl)-1-(furan-2-ylmethyl)-5-oxopyrrolidine-3-carboxamide
CID 6931900
1-(furan-2-ylmethyl)-N-(2-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 78768111

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide (CID 47099759) is 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide is CNC(=O)C1CC(=O)N(Cc2ccco2)C1.
What is the InChIKey of 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is PFZFGVXQXYRQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-12-11(15)8-5-10(14)13(6-8)7-9-3-2-4-16-9/h2-4,8H,5-7H2,1H3,(H,12,15).
What are the key properties of 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide?
1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 222.24 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-N-methyl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 47099759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).