N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine

C12H25N3 — CID 83009098

IUPACN-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine
SMILESCN1CCN(NC2CCCC2(C)C)CC1
InChIInChI=1S/C12H25N3/c1-12(2)6-4-5-11(12)13-15-9-7-14(3)8-10-15/h11,13H,4-10H2,1-3H3
InChIKeyJKWHLCRNAASDLE-UHFFFAOYSA-N
MW211.35 g/mol
LogP1.32
Rot. Bonds2

About N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine

N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine (PubChem CID 83009098) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine
PubChem CID83009098
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC NameN-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine
SMILESCN1CCN(NC2CCCC2(C)C)CC1
InChIInChI=1S/C12H25N3/c1-12(2)6-4-5-11(12)13-15-9-7-14(3)8-10-15/h11,13H,4-10H2,1-3H3
InChIKeyJKWHLCRNAASDLE-UHFFFAOYSA-N
XLogP1.32
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine?
The IUPAC name of N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine (CID 83009098) is N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine.
What is the SMILES notation for N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine?
The canonical SMILES for N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine is CN1CCN(NC2CCCC2(C)C)CC1.
What is the InChIKey of N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine?
The InChIKey is JKWHLCRNAASDLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-12(2)6-4-5-11(12)13-15-9-7-14(3)8-10-15/h11,13H,4-10H2,1-3H3.
What are the key properties of N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine?
N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine has a molecular weight of 211.35 g/mol, XLogP of 1.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopentyl)-4-methylpiperazin-1-amine is sourced from PubChem (CID 83009098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).