3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine

C16H28N4 — CID 64951986

IUPAC3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
SMILESCC(C)n1cc(N2CCNC(C3CCCCC3)C2)cn1
InChIInChI=1S/C16H28N4/c1-13(2)20-11-15(10-18-20)19-9-8-17-16(12-19)14-6-4-3-5-7-14/h10-11,13-14,16-17H,3-9,12H2,1-2H3
InChIKeyKAKYQMJDJYZLEI-UHFFFAOYSA-N
MW276.43 g/mol
LogP2.82
Rot. Bonds3

About 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine

3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine (PubChem CID 64951986) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine.

Molecular Properties

Compound Name3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
PubChem CID64951986
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
SMILESCC(C)n1cc(N2CCNC(C3CCCCC3)C2)cn1
InChIInChI=1S/C16H28N4/c1-13(2)20-11-15(10-18-20)19-9-8-17-16(12-19)14-6-4-3-5-7-14/h10-11,13-14,16-17H,3-9,12H2,1-2H3
InChIKeyKAKYQMJDJYZLEI-UHFFFAOYSA-N
XLogP2.82
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine 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

3-cyclohexyl-1-(3,5-dimethylphenyl)piperazine
CID 64925415
3-phenyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
CID 64952189
3-cyclohexyl-1-pyrimidin-5-yl-1,4-diazepane
CID 107590166
3-cyclohexyl-1-(4-methyl-3-pyridinyl)piperazine
CID 64952009
[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-(1-propan-2-ylpyrazol-4-yl)methanone
CID 70715204
1-(2-bromophenyl)-3-cyclohexylpiperazine
CID 64926277
3-cyclohexyl-1-(2-fluoro-4-methylphenyl)piperazine
CID 64925423
1-(3-bromo-2-methylphenyl)-3-cyclohexylpiperazine
CID 107639855
1-propan-2-yl-4-pyrrolidin-2-ylpyrazole
CID 83828132
5-methyl-2-propan-2-yl-1-(1-propan-2-ylpyrazol-4-yl)piperazine
CID 64937028
7-(3-cyclohexylpiperazin-1-yl)-2H-quinolin-3-one
CID 70467206
3-cyclohexyl-1-(2,3-difluorophenyl)piperazine
CID 64924730

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
The IUPAC name of 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine (CID 64951986) is 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine.
What is the SMILES notation for 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
The canonical SMILES for 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine is CC(C)n1cc(N2CCNC(C3CCCCC3)C2)cn1.
What is the InChIKey of 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
The InChIKey is KAKYQMJDJYZLEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-13(2)20-11-15(10-18-20)19-9-8-17-16(12-19)14-6-4-3-5-7-14/h10-11,13-14,16-17H,3-9,12H2,1-2H3.
What are the key properties of 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine?
3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine has a molecular weight of 276.43 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-(1-propan-2-ylpyrazol-4-yl)piperazine is sourced from PubChem (CID 64951986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).