1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine

C16H32N2 — CID 64932315

IUPAC1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine
SMILESCCC(C1CCCCC1)N1CCNCC1C(C)C
InChIInChI=1S/C16H32N2/c1-4-15(14-8-6-5-7-9-14)18-11-10-17-12-16(18)13(2)3/h13-17H,4-12H2,1-3H3
InChIKeyKAOCBOLVEDZZGE-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds4

About 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine

1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine (PubChem CID 64932315) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine
PubChem CID64932315
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine
SMILESCCC(C1CCCCC1)N1CCNCC1C(C)C
InChIInChI=1S/C16H32N2/c1-4-15(14-8-6-5-7-9-14)18-11-10-17-12-16(18)13(2)3/h13-17H,4-12H2,1-3H3
InChIKeyKAOCBOLVEDZZGE-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine?
The IUPAC name of 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine (CID 64932315) is 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine is CCC(C1CCCCC1)N1CCNCC1C(C)C.
What is the InChIKey of 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine?
The InChIKey is KAOCBOLVEDZZGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-4-15(14-8-6-5-7-9-14)18-11-10-17-12-16(18)13(2)3/h13-17H,4-12H2,1-3H3.
What are the key properties of 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine?
1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylpropyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64932315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).