1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one

C10H11NO3 — CID 130884488

IUPAC1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one
SMILESCc1ccc(C(=O)N2CCC(=O)C2)o1
InChIInChI=1S/C10H11NO3/c1-7-2-3-9(14-7)10(13)11-5-4-8(12)6-11/h2-3H,4-6H2,1H3
InChIKeyHHXDKAUBJSCHFW-UHFFFAOYSA-N
MW193.20 g/mol
LogP1.00
Rot. Bonds1

About 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one

1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one (PubChem CID 130884488) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one.

Molecular Properties

Compound Name1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one
PubChem CID130884488
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one
SMILESCc1ccc(C(=O)N2CCC(=O)C2)o1
InChIInChI=1S/C10H11NO3/c1-7-2-3-9(14-7)10(13)11-5-4-8(12)6-11/h2-3H,4-6H2,1H3
InChIKeyHHXDKAUBJSCHFW-UHFFFAOYSA-N
XLogP1.00
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one?
The IUPAC name of 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one (CID 130884488) is 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one.
What is the SMILES notation for 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one?
The canonical SMILES for 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one is Cc1ccc(C(=O)N2CCC(=O)C2)o1.
What is the InChIKey of 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one?
The InChIKey is HHXDKAUBJSCHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO3/c1-7-2-3-9(14-7)10(13)11-5-4-8(12)6-11/h2-3H,4-6H2,1H3.
What are the key properties of 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one?
1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one has a molecular weight of 193.20 g/mol, XLogP of 1.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylfuran-2-carbonyl)pyrrolidin-3-one is sourced from PubChem (CID 130884488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).