3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine

C16H30N2 — CID 114112213

IUPAC3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine
SMILESCC(C)(C1CC1)N1CCNC(C2CCCCC2)C1
InChIInChI=1S/C16H30N2/c1-16(2,14-8-9-14)18-11-10-17-15(12-18)13-6-4-3-5-7-13/h13-15,17H,3-12H2,1-2H3
InChIKeyCSOAWEMHACFGCL-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.03
Rot. Bonds3

About 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine

3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine (PubChem CID 114112213) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine.

Molecular Properties

Compound Name3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine
PubChem CID114112213
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine
SMILESCC(C)(C1CC1)N1CCNC(C2CCCCC2)C1
InChIInChI=1S/C16H30N2/c1-16(2,14-8-9-14)18-11-10-17-15(12-18)13-6-4-3-5-7-13/h13-15,17H,3-12H2,1-2H3
InChIKeyCSOAWEMHACFGCL-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine?
The IUPAC name of 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine (CID 114112213) is 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine.
What is the SMILES notation for 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine?
The canonical SMILES for 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine is CC(C)(C1CC1)N1CCNC(C2CCCCC2)C1.
What is the InChIKey of 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine?
The InChIKey is CSOAWEMHACFGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-16(2,14-8-9-14)18-11-10-17-15(12-18)13-6-4-3-5-7-13/h13-15,17H,3-12H2,1-2H3.
What are the key properties of 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine?
3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine has a molecular weight of 250.43 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-(2-cyclopropylpropan-2-yl)piperazine is sourced from PubChem (CID 114112213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).