1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine

C16H30N2 — CID 82936167

IUPAC1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine
SMILESCC(C)C1CN(C2CCCC2)C(C)(C2CC2)CN1
InChIInChI=1S/C16H30N2/c1-12(2)15-10-18(14-6-4-5-7-14)16(3,11-17-15)13-8-9-13/h12-15,17H,4-11H2,1-3H3
InChIKeyXJFBHSHHLFZXRR-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.03
Rot. Bonds3

About 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine

1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine (PubChem CID 82936167) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine
PubChem CID82936167
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine
SMILESCC(C)C1CN(C2CCCC2)C(C)(C2CC2)CN1
InChIInChI=1S/C16H30N2/c1-12(2)15-10-18(14-6-4-5-7-14)16(3,11-17-15)13-8-9-13/h12-15,17H,4-11H2,1-3H3
InChIKeyXJFBHSHHLFZXRR-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine?
The IUPAC name of 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine (CID 82936167) is 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine.
What is the SMILES notation for 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine?
The canonical SMILES for 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine is CC(C)C1CN(C2CCCC2)C(C)(C2CC2)CN1.
What is the InChIKey of 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine?
The InChIKey is XJFBHSHHLFZXRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-12(2)15-10-18(14-6-4-5-7-14)16(3,11-17-15)13-8-9-13/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine?
1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine has a molecular weight of 250.43 g/mol, XLogP of 3.03, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine is sourced from PubChem (CID 82936167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).