5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine

C16H32N2 — CID 64941954

IUPAC5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine
SMILESCC(C)CCCN1CC(C2CC2)NCC1C(C)C
InChIInChI=1S/C16H32N2/c1-12(2)6-5-9-18-11-15(14-7-8-14)17-10-16(18)13(3)4/h12-17H,5-11H2,1-4H3
InChIKeySPIAEABAHRKQTI-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.13
Rot. Bonds6

About 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine

5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine (PubChem CID 64941954) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine
PubChem CID64941954
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine
SMILESCC(C)CCCN1CC(C2CC2)NCC1C(C)C
InChIInChI=1S/C16H32N2/c1-12(2)6-5-9-18-11-15(14-7-8-14)17-10-16(18)13(3)4/h12-17H,5-11H2,1-4H3
InChIKeySPIAEABAHRKQTI-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine?
The IUPAC name of 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine (CID 64941954) is 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine is CC(C)CCCN1CC(C2CC2)NCC1C(C)C.
What is the InChIKey of 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine?
The InChIKey is SPIAEABAHRKQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-12(2)6-5-9-18-11-15(14-7-8-14)17-10-16(18)13(3)4/h12-17H,5-11H2,1-4H3.
What are the key properties of 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine?
5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.13, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-(4-methylpentyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64941954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).