1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine

C13H27N3 — CID 115415158

IUPAC1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine
SMILESCN1CCN(C)C(CC(N)C2CCCC2)C1
InChIInChI=1S/C13H27N3/c1-15-7-8-16(2)12(10-15)9-13(14)11-5-3-4-6-11/h11-13H,3-10,14H2,1-2H3
InChIKeyZXTCMMNEPNLILO-UHFFFAOYSA-N
MW225.38 g/mol
LogP1.14
Rot. Bonds3

About 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine

1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine (PubChem CID 115415158) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine
PubChem CID115415158
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine
SMILESCN1CCN(C)C(CC(N)C2CCCC2)C1
InChIInChI=1S/C13H27N3/c1-15-7-8-16(2)12(10-15)9-13(14)11-5-3-4-6-11/h11-13H,3-10,14H2,1-2H3
InChIKeyZXTCMMNEPNLILO-UHFFFAOYSA-N
XLogP1.14
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 28901865
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3-(1-Methylpyrrolidin-2-yl)piperidine
CID 219458
(2-Amino-1-cyclohexylethyl)dimethylamine
CID 16228005
3-Butyl-1-cyclohexylpiperidin-4-amine
CID 11659120
2-(1,4-Dimethylpiperazin-2-yl)-3-methylpentan-1-amine
CID 3052885
(1-Cyclopentylpiperidin-3-yl)methanamine
CID 23004735
1-(4-Methylpiperidin-1-yl)propan-2-amine
CID 12700153
[(2S)-2-amino-2-cyclohexylethyl]dimethylamine
CID 58598201
I(2)-Cyclohexyl-4-methyl-1-piperazineethanamine
CID 16789275
1-(Cyclopentylmethyl)piperidin-4-amine
CID 20395869
1-Methyl-3-(pyrrolidin-2-yl)piperidine
CID 4020197

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine?
The IUPAC name of 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine (CID 115415158) is 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine.
What is the SMILES notation for 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine?
The canonical SMILES for 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine is CN1CCN(C)C(CC(N)C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine?
The InChIKey is ZXTCMMNEPNLILO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-15-7-8-16(2)12(10-15)9-13(14)11-5-3-4-6-11/h11-13H,3-10,14H2,1-2H3.
What are the key properties of 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine?
1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine has a molecular weight of 225.38 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(1,4-dimethylpiperazin-2-yl)ethanamine is sourced from PubChem (CID 115415158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).