1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine

C16H30N2 — CID 106008956

IUPAC1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine
SMILESCC1(C2CC2)CN(CCCC2CCCC2)CCN1
InChIInChI=1S/C16H30N2/c1-16(15-8-9-15)13-18(12-10-17-16)11-4-7-14-5-2-3-6-14/h14-15,17H,2-13H2,1H3
InChIKeyWSMOICKIRDWCEM-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.03
Rot. Bonds5

About 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine

1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine (PubChem CID 106008956) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine.

Molecular Properties

Compound Name1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine
PubChem CID106008956
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine
SMILESCC1(C2CC2)CN(CCCC2CCCC2)CCN1
InChIInChI=1S/C16H30N2/c1-16(15-8-9-15)13-18(12-10-17-16)11-4-7-14-5-2-3-6-14/h14-15,17H,2-13H2,1H3
InChIKeyWSMOICKIRDWCEM-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine?
The IUPAC name of 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine (CID 106008956) is 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine.
What is the SMILES notation for 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine?
The canonical SMILES for 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine is CC1(C2CC2)CN(CCCC2CCCC2)CCN1.
What is the InChIKey of 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine?
The InChIKey is WSMOICKIRDWCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-16(15-8-9-15)13-18(12-10-17-16)11-4-7-14-5-2-3-6-14/h14-15,17H,2-13H2,1H3.
What are the key properties of 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine?
1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine has a molecular weight of 250.43 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentylpropyl)-3-cyclopropyl-3-methylpiperazine is sourced from PubChem (CID 106008956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).