1-(4-cyclohexylpiperidin-1-yl)propan-1-one

C14H25NO — CID 71192084

IUPAC1-(4-cyclohexylpiperidin-1-yl)propan-1-one
SMILESCCC(=O)N1CCC(C2CCCCC2)CC1
InChIInChI=1S/C14H25NO/c1-2-14(16)15-10-8-13(9-11-15)12-6-4-3-5-7-12/h12-13H,2-11H2,1H3
InChIKeyRWKVHNLYWGHGIW-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.22
Rot. Bonds2

About 1-(4-cyclohexylpiperidin-1-yl)propan-1-one

1-(4-cyclohexylpiperidin-1-yl)propan-1-one (PubChem CID 71192084) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(4-cyclohexylpiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name1-(4-cyclohexylpiperidin-1-yl)propan-1-one
PubChem CID71192084
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(4-cyclohexylpiperidin-1-yl)propan-1-one
SMILESCCC(=O)N1CCC(C2CCCCC2)CC1
InChIInChI=1S/C14H25NO/c1-2-14(16)15-10-8-13(9-11-15)12-6-4-3-5-7-12/h12-13H,2-11H2,1H3
InChIKeyRWKVHNLYWGHGIW-UHFFFAOYSA-N
XLogP3.22
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(4-cyclohexylpiperidin-1-yl)propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclohexylpiperidin-1-yl)propan-1-one?
The IUPAC name of 1-(4-cyclohexylpiperidin-1-yl)propan-1-one (CID 71192084) is 1-(4-cyclohexylpiperidin-1-yl)propan-1-one.
What is the SMILES notation for 1-(4-cyclohexylpiperidin-1-yl)propan-1-one?
The canonical SMILES for 1-(4-cyclohexylpiperidin-1-yl)propan-1-one is CCC(=O)N1CCC(C2CCCCC2)CC1.
What is the InChIKey of 1-(4-cyclohexylpiperidin-1-yl)propan-1-one?
The InChIKey is RWKVHNLYWGHGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-14(16)15-10-8-13(9-11-15)12-6-4-3-5-7-12/h12-13H,2-11H2,1H3.
What are the key properties of 1-(4-cyclohexylpiperidin-1-yl)propan-1-one?
1-(4-cyclohexylpiperidin-1-yl)propan-1-one has a molecular weight of 223.36 g/mol, XLogP of 3.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclohexylpiperidin-1-yl)propan-1-one is sourced from PubChem (CID 71192084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).