N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine

C13H27N3 — CID 80551380

IUPACN-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine
SMILESCC(C)(CNC1CCCC1)N1CCNCC1
InChIInChI=1S/C13H27N3/c1-13(2,16-9-7-14-8-10-16)11-15-12-5-3-4-6-12/h12,14-15H,3-11H2,1-2H3
InChIKeyLZHWVEMKLDXBAF-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.20
Rot. Bonds4

About N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine

N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine (PubChem CID 80551380) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine.

Molecular Properties

Compound NameN-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine
PubChem CID80551380
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC NameN-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine
SMILESCC(C)(CNC1CCCC1)N1CCNCC1
InChIInChI=1S/C13H27N3/c1-13(2,16-9-7-14-8-10-16)11-15-12-5-3-4-6-12/h12,14-15H,3-11H2,1-2H3
InChIKeyLZHWVEMKLDXBAF-UHFFFAOYSA-N
XLogP1.20
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine?
The IUPAC name of N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine (CID 80551380) is N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine.
What is the SMILES notation for N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine?
The canonical SMILES for N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine is CC(C)(CNC1CCCC1)N1CCNCC1.
What is the InChIKey of N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine?
The InChIKey is LZHWVEMKLDXBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-13(2,16-9-7-14-8-10-16)11-15-12-5-3-4-6-12/h12,14-15H,3-11H2,1-2H3.
What are the key properties of N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine?
N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine has a molecular weight of 225.38 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-piperazin-1-ylpropyl)cyclopentanamine is sourced from PubChem (CID 80551380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).