5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine

C18H34N2 — CID 64934247

IUPAC5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C2CCCCC2)CN1C(C)C1CC1
InChIInChI=1S/C18H34N2/c1-13(2)18-11-19-17(16-7-5-4-6-8-16)12-20(18)14(3)15-9-10-15/h13-19H,4-12H2,1-3H3
InChIKeyCKDRXLPWTRLDLK-UHFFFAOYSA-N
MW278.48 g/mol
LogP3.66
Rot. Bonds4

About 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine

5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine (PubChem CID 64934247) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine
PubChem CID64934247
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C2CCCCC2)CN1C(C)C1CC1
InChIInChI=1S/C18H34N2/c1-13(2)18-11-19-17(16-7-5-4-6-8-16)12-20(18)14(3)15-9-10-15/h13-19H,4-12H2,1-3H3
InChIKeyCKDRXLPWTRLDLK-UHFFFAOYSA-N
XLogP3.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine?
The IUPAC name of 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine (CID 64934247) is 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine is CC(C)C1CNC(C2CCCCC2)CN1C(C)C1CC1.
What is the InChIKey of 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine?
The InChIKey is CKDRXLPWTRLDLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-13(2)18-11-19-17(16-7-5-4-6-8-16)12-20(18)14(3)15-9-10-15/h13-19H,4-12H2,1-3H3.
What are the key properties of 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine?
5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine has a molecular weight of 278.48 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-1-(1-cyclopropylethyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64934247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).