3-cyclohexyl-3,4-dihydropyrrol-2-one

C10H15NO — CID 162720019

IUPAC3-cyclohexyl-3,4-dihydropyrrol-2-one
SMILESO=C1N=CCC1C1CCCCC1
InChIInChI=1S/C10H15NO/c12-10-9(6-7-11-10)8-4-2-1-3-5-8/h7-9H,1-6H2
InChIKeyWREWQHWYPUZKOJ-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.18
Rot. Bonds1

About 3-cyclohexyl-3,4-dihydropyrrol-2-one

3-cyclohexyl-3,4-dihydropyrrol-2-one (PubChem CID 162720019) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 3-cyclohexyl-3,4-dihydropyrrol-2-one.

Molecular Properties

Compound Name3-cyclohexyl-3,4-dihydropyrrol-2-one
PubChem CID162720019
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name3-cyclohexyl-3,4-dihydropyrrol-2-one
SMILESO=C1N=CCC1C1CCCCC1
InChIInChI=1S/C10H15NO/c12-10-9(6-7-11-10)8-4-2-1-3-5-8/h7-9H,1-6H2
InChIKeyWREWQHWYPUZKOJ-UHFFFAOYSA-N
XLogP2.18
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-3,4-dihydropyrrol-2-one?
The IUPAC name of 3-cyclohexyl-3,4-dihydropyrrol-2-one (CID 162720019) is 3-cyclohexyl-3,4-dihydropyrrol-2-one.
What is the SMILES notation for 3-cyclohexyl-3,4-dihydropyrrol-2-one?
The canonical SMILES for 3-cyclohexyl-3,4-dihydropyrrol-2-one is O=C1N=CCC1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-3,4-dihydropyrrol-2-one?
The InChIKey is WREWQHWYPUZKOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c12-10-9(6-7-11-10)8-4-2-1-3-5-8/h7-9H,1-6H2.
What are the key properties of 3-cyclohexyl-3,4-dihydropyrrol-2-one?
3-cyclohexyl-3,4-dihydropyrrol-2-one has a molecular weight of 165.24 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-3,4-dihydropyrrol-2-one is sourced from PubChem (CID 162720019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).