5-cyclopropylidene-1-methylpyrrol-2-one

C8H9NO — CID 89201564

IUPAC5-cyclopropylidene-1-methylpyrrol-2-one
SMILESCN1C(=O)C=CC1=C1CC1
InChIInChI=1S/C8H9NO/c1-9-7(6-2-3-6)4-5-8(9)10/h4-5H,2-3H2,1H3
InChIKeyFXEXBMYUWKCZRV-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.06
Rot. Bonds

About 5-cyclopropylidene-1-methylpyrrol-2-one

5-cyclopropylidene-1-methylpyrrol-2-one (PubChem CID 89201564) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is 5-cyclopropylidene-1-methylpyrrol-2-one.

Molecular Properties

Compound Name5-cyclopropylidene-1-methylpyrrol-2-one
PubChem CID89201564
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name5-cyclopropylidene-1-methylpyrrol-2-one
SMILESCN1C(=O)C=CC1=C1CC1
InChIInChI=1S/C8H9NO/c1-9-7(6-2-3-6)4-5-8(9)10/h4-5H,2-3H2,1H3
InChIKeyFXEXBMYUWKCZRV-UHFFFAOYSA-N
XLogP1.06
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropylidene-1-methylpyrrol-2-one?
The IUPAC name of 5-cyclopropylidene-1-methylpyrrol-2-one (CID 89201564) is 5-cyclopropylidene-1-methylpyrrol-2-one.
What is the SMILES notation for 5-cyclopropylidene-1-methylpyrrol-2-one?
The canonical SMILES for 5-cyclopropylidene-1-methylpyrrol-2-one is CN1C(=O)C=CC1=C1CC1.
What is the InChIKey of 5-cyclopropylidene-1-methylpyrrol-2-one?
The InChIKey is FXEXBMYUWKCZRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO/c1-9-7(6-2-3-6)4-5-8(9)10/h4-5H,2-3H2,1H3.
What are the key properties of 5-cyclopropylidene-1-methylpyrrol-2-one?
5-cyclopropylidene-1-methylpyrrol-2-one has a molecular weight of 135.17 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropylidene-1-methylpyrrol-2-one is sourced from PubChem (CID 89201564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).