1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine

C16H30N2 — CID 82936537

IUPAC1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
SMILESCC(C)CC1CNC(C2CC2)CN1C1CCCC1
InChIInChI=1S/C16H30N2/c1-12(2)9-15-10-17-16(13-7-8-13)11-18(15)14-5-3-4-6-14/h12-17H,3-11H2,1-2H3
InChIKeyJMSMUAQUPRVYCA-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.03
Rot. Bonds4

About 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine

1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine (PubChem CID 82936537) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
PubChem CID82936537
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
SMILESCC(C)CC1CNC(C2CC2)CN1C1CCCC1
InChIInChI=1S/C16H30N2/c1-12(2)9-15-10-17-16(13-7-8-13)11-18(15)14-5-3-4-6-14/h12-17H,3-11H2,1-2H3
InChIKeyJMSMUAQUPRVYCA-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine?
The IUPAC name of 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine (CID 82936537) is 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine?
The canonical SMILES for 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine is CC(C)CC1CNC(C2CC2)CN1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine?
The InChIKey is JMSMUAQUPRVYCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-12(2)9-15-10-17-16(13-7-8-13)11-18(15)14-5-3-4-6-14/h12-17H,3-11H2,1-2H3.
What are the key properties of 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine?
1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine has a molecular weight of 250.43 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine is sourced from PubChem (CID 82936537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).