1-(2-cyclohexylethenyl)pyrrolidin-2-one

C12H19NO — CID 67565669

IUPAC1-(2-cyclohexylethenyl)pyrrolidin-2-one
SMILESO=C1CCCN1C=CC1CCCCC1
InChIInChI=1S/C12H19NO/c14-12-7-4-9-13(12)10-8-11-5-2-1-3-6-11/h8,10-11H,1-7,9H2
InChIKeyCHLGGJZYPGLOCG-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.70
Rot. Bonds2

About 1-(2-cyclohexylethenyl)pyrrolidin-2-one

1-(2-cyclohexylethenyl)pyrrolidin-2-one (PubChem CID 67565669) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-(2-cyclohexylethenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-cyclohexylethenyl)pyrrolidin-2-one
PubChem CID67565669
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name1-(2-cyclohexylethenyl)pyrrolidin-2-one
SMILESO=C1CCCN1C=CC1CCCCC1
InChIInChI=1S/C12H19NO/c14-12-7-4-9-13(12)10-8-11-5-2-1-3-6-11/h8,10-11H,1-7,9H2
InChIKeyCHLGGJZYPGLOCG-UHFFFAOYSA-N
XLogP2.70
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylethenyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-cyclohexylethenyl)pyrrolidin-2-one (CID 67565669) is 1-(2-cyclohexylethenyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-cyclohexylethenyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-cyclohexylethenyl)pyrrolidin-2-one is O=C1CCCN1C=CC1CCCCC1.
What is the InChIKey of 1-(2-cyclohexylethenyl)pyrrolidin-2-one?
The InChIKey is CHLGGJZYPGLOCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c14-12-7-4-9-13(12)10-8-11-5-2-1-3-6-11/h8,10-11H,1-7,9H2.
What are the key properties of 1-(2-cyclohexylethenyl)pyrrolidin-2-one?
1-(2-cyclohexylethenyl)pyrrolidin-2-one has a molecular weight of 193.29 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylethenyl)pyrrolidin-2-one is sourced from PubChem (CID 67565669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).