2-cyclohexyl-1-piperazin-1-ylethanone

C12H22N2O — CID 43209676

IUPAC2-cyclohexyl-1-piperazin-1-ylethanone
SMILESO=C(CC1CCCCC1)N1CCNCC1
InChIInChI=1S/C12H22N2O/c15-12(14-8-6-13-7-9-14)10-11-4-2-1-3-5-11/h11,13H,1-10H2
InChIKeyNMCANBKLWBDZOP-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.39
Rot. Bonds2

About 2-cyclohexyl-1-piperazin-1-ylethanone

2-cyclohexyl-1-piperazin-1-ylethanone (PubChem CID 43209676) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 2-cyclohexyl-1-piperazin-1-ylethanone.

Molecular Properties

Compound Name2-cyclohexyl-1-piperazin-1-ylethanone
PubChem CID43209676
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name2-cyclohexyl-1-piperazin-1-ylethanone
SMILESO=C(CC1CCCCC1)N1CCNCC1
InChIInChI=1S/C12H22N2O/c15-12(14-8-6-13-7-9-14)10-11-4-2-1-3-5-11/h11,13H,1-10H2
InChIKeyNMCANBKLWBDZOP-UHFFFAOYSA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-cyclohexyl-1-piperazin-1-ylethanone with MolForge

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

Launch Full Analysis

Related Compounds

Pexantel
CID 667497
Adamantan-1-yl-piperazin-1-yl-methanone
CID 17233943
N,3-dicyclohexylpropanamide
CID 759108
3-Cyclopentyl-1-(piperazin-1-yl)propan-1-one
CID 767567
(2S)-2-amino-2-cyclohexyl-1-(piperidin-1-yl)ethan-1-one
CID 23646030
N,2-dicyclohexylacetamide
CID 880907
N-(cyclohexylmethyl)cyclohexanecarboxamide
CID 4051138
N-(piperidin-4-yl)cyclohexanecarboxamide
CID 1445167
2-(cyclohexylformamido)-N,N-dimethylacetamide
CID 800131
3-cyclohexyl-N-[3-(dimethylamino)propyl]propanamide
CID 2582372
trans-(1R,2R)-N-(cyanomethyl)-2-(piperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 60195810
trans-(1R,2R)-N-(cyanomethyl)-2-(4-methylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 60195813

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-piperazin-1-ylethanone?
The IUPAC name of 2-cyclohexyl-1-piperazin-1-ylethanone (CID 43209676) is 2-cyclohexyl-1-piperazin-1-ylethanone.
What is the SMILES notation for 2-cyclohexyl-1-piperazin-1-ylethanone?
The canonical SMILES for 2-cyclohexyl-1-piperazin-1-ylethanone is O=C(CC1CCCCC1)N1CCNCC1.
What is the InChIKey of 2-cyclohexyl-1-piperazin-1-ylethanone?
The InChIKey is NMCANBKLWBDZOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c15-12(14-8-6-13-7-9-14)10-11-4-2-1-3-5-11/h11,13H,1-10H2.
What are the key properties of 2-cyclohexyl-1-piperazin-1-ylethanone?
2-cyclohexyl-1-piperazin-1-ylethanone has a molecular weight of 210.32 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-piperazin-1-ylethanone is sourced from PubChem (CID 43209676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).