3-phenyl-1-(4-propylcyclohexyl)piperazine

C19H30N2 — CID 64924571

IUPAC3-phenyl-1-(4-propylcyclohexyl)piperazine
SMILESCCCC1CCC(N2CCNC(c3ccccc3)C2)CC1
InChIInChI=1S/C19H30N2/c1-2-6-16-9-11-18(12-10-16)21-14-13-20-19(15-21)17-7-4-3-5-8-17/h3-5,7-8,16,18-20H,2,6,9-15H2,1H3
InChIKeyWWDBRGIJRDVSEZ-UHFFFAOYSA-N
MW286.46 g/mol
LogP3.99
Rot. Bonds4

About 3-phenyl-1-(4-propylcyclohexyl)piperazine

3-phenyl-1-(4-propylcyclohexyl)piperazine (PubChem CID 64924571) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 3-phenyl-1-(4-propylcyclohexyl)piperazine.

Molecular Properties

Compound Name3-phenyl-1-(4-propylcyclohexyl)piperazine
PubChem CID64924571
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name3-phenyl-1-(4-propylcyclohexyl)piperazine
SMILESCCCC1CCC(N2CCNC(c3ccccc3)C2)CC1
InChIInChI=1S/C19H30N2/c1-2-6-16-9-11-18(12-10-16)21-14-13-20-19(15-21)17-7-4-3-5-8-17/h3-5,7-8,16,18-20H,2,6,9-15H2,1H3
InChIKeyWWDBRGIJRDVSEZ-UHFFFAOYSA-N
XLogP3.99
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-phenyl-1-(4-propylcyclohexyl)piperazine?
The IUPAC name of 3-phenyl-1-(4-propylcyclohexyl)piperazine (CID 64924571) is 3-phenyl-1-(4-propylcyclohexyl)piperazine.
What is the SMILES notation for 3-phenyl-1-(4-propylcyclohexyl)piperazine?
The canonical SMILES for 3-phenyl-1-(4-propylcyclohexyl)piperazine is CCCC1CCC(N2CCNC(c3ccccc3)C2)CC1.
What is the InChIKey of 3-phenyl-1-(4-propylcyclohexyl)piperazine?
The InChIKey is WWDBRGIJRDVSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-2-6-16-9-11-18(12-10-16)21-14-13-20-19(15-21)17-7-4-3-5-8-17/h3-5,7-8,16,18-20H,2,6,9-15H2,1H3.
What are the key properties of 3-phenyl-1-(4-propylcyclohexyl)piperazine?
3-phenyl-1-(4-propylcyclohexyl)piperazine has a molecular weight of 286.46 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-1-(4-propylcyclohexyl)piperazine is sourced from PubChem (CID 64924571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).