2-(cyclohexylamino)cyclopent-2-en-1-one

C11H17NO — CID 86168964

IUPAC2-(cyclohexylamino)cyclopent-2-en-1-one
SMILESO=C1CCC=C1NC1CCCCC1
InChIInChI=1S/C11H17NO/c13-11-8-4-7-10(11)12-9-5-2-1-3-6-9/h7,9,12H,1-6,8H2
InChIKeyFCVMHPZNIUGRAP-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.16
Rot. Bonds2

About 2-(cyclohexylamino)cyclopent-2-en-1-one

2-(cyclohexylamino)cyclopent-2-en-1-one (PubChem CID 86168964) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-(cyclohexylamino)cyclopent-2-en-1-one.

Molecular Properties

Compound Name2-(cyclohexylamino)cyclopent-2-en-1-one
PubChem CID86168964
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-(cyclohexylamino)cyclopent-2-en-1-one
SMILESO=C1CCC=C1NC1CCCCC1
InChIInChI=1S/C11H17NO/c13-11-8-4-7-10(11)12-9-5-2-1-3-6-9/h7,9,12H,1-6,8H2
InChIKeyFCVMHPZNIUGRAP-UHFFFAOYSA-N
XLogP2.16
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)cyclopent-2-en-1-one?
The IUPAC name of 2-(cyclohexylamino)cyclopent-2-en-1-one (CID 86168964) is 2-(cyclohexylamino)cyclopent-2-en-1-one.
What is the SMILES notation for 2-(cyclohexylamino)cyclopent-2-en-1-one?
The canonical SMILES for 2-(cyclohexylamino)cyclopent-2-en-1-one is O=C1CCC=C1NC1CCCCC1.
What is the InChIKey of 2-(cyclohexylamino)cyclopent-2-en-1-one?
The InChIKey is FCVMHPZNIUGRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c13-11-8-4-7-10(11)12-9-5-2-1-3-6-9/h7,9,12H,1-6,8H2.
What are the key properties of 2-(cyclohexylamino)cyclopent-2-en-1-one?
2-(cyclohexylamino)cyclopent-2-en-1-one has a molecular weight of 179.26 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)cyclopent-2-en-1-one is sourced from PubChem (CID 86168964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).