1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine

C12H22N2 — CID 106172733

IUPAC1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine
SMILESCC1CNCCN1CCC1=CCCC1
InChIInChI=1S/C12H22N2/c1-11-10-13-7-9-14(11)8-6-12-4-2-3-5-12/h4,11,13H,2-3,5-10H2,1H3
InChIKeyOTQYQASGYRBJIW-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.78
Rot. Bonds3

About 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine

1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine (PubChem CID 106172733) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine.

Molecular Properties

Compound Name1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine
PubChem CID106172733
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine
SMILESCC1CNCCN1CCC1=CCCC1
InChIInChI=1S/C12H22N2/c1-11-10-13-7-9-14(11)8-6-12-4-2-3-5-12/h4,11,13H,2-3,5-10H2,1H3
InChIKeyOTQYQASGYRBJIW-UHFFFAOYSA-N
XLogP1.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-[2-(cyclohexen-1-yl)ethyl]-2-methylpiperazine
CID 82077738
1-[2-(cyclopenten-1-yl)ethyl]-2-propan-2-ylpiperazine
CID 106172747
4-[2-(2-methylazetidin-1-yl)ethyl]-1,2,3,6-tetrahydropyridine
CID 107489783
(2S)-2-methyl-1-(2-pyridin-4-ylethyl)piperazine
CID 82713118
5-[2-(2-methylpiperazin-1-yl)ethyl]-1,2,4-oxadiazole
CID 106408735
(2R)-1-(2-fluoroethyl)-2-methylpiperazine
CID 82761196
(2R)-2-methyl-1-(2-piperidin-1-ylethyl)piperazine
CID 82761100
(2S)-2-methyl-1-(2-piperidin-1-ylethyl)piperazine
CID 82755408
1-[2-(2-methoxyphenyl)ethyl]-2-methylpiperazine
CID 82083206
2-methyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64565894
(2R)-1-(3-fluoropropyl)-2-methylpiperazine
CID 82761622
1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine
CID 106172740

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine?
The IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine (CID 106172733) is 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine.
What is the SMILES notation for 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine?
The canonical SMILES for 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine is CC1CNCCN1CCC1=CCCC1.
What is the InChIKey of 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine?
The InChIKey is OTQYQASGYRBJIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-11-10-13-7-9-14(11)8-6-12-4-2-3-5-12/h4,11,13H,2-3,5-10H2,1H3.
What are the key properties of 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine?
1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine has a molecular weight of 194.32 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine is sourced from PubChem (CID 106172733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).