1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine

C16H28N2 — CID 114153759

IUPAC1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine
SMILESCC1CNC(C)(C2CC2)CN1CCC1=CCCC1
InChIInChI=1S/C16H28N2/c1-13-11-17-16(2,15-7-8-15)12-18(13)10-9-14-5-3-4-6-14/h5,13,15,17H,3-4,6-12H2,1-2H3
InChIKeyDCVDTYRVGLORFQ-UHFFFAOYSA-N
MW248.41 g/mol
LogP2.95
Rot. Bonds4

About 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine

1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine (PubChem CID 114153759) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine.

Molecular Properties

Compound Name1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine
PubChem CID114153759
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC Name1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine
SMILESCC1CNC(C)(C2CC2)CN1CCC1=CCCC1
InChIInChI=1S/C16H28N2/c1-13-11-17-16(2,15-7-8-15)12-18(13)10-9-14-5-3-4-6-14/h5,13,15,17H,3-4,6-12H2,1-2H3
InChIKeyDCVDTYRVGLORFQ-UHFFFAOYSA-N
XLogP2.95
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 52.95
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-(cyclopenten-1-yl)ethyl]-2,5-dimethylpiperazine
CID 106172766
1-[2-(cyclopenten-1-yl)ethyl]-2-methylpiperazine
CID 106172733
1-[2-(cyclopenten-1-yl)ethyl]-2,5,5-triethylpiperazine
CID 106172740
1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2-methylpiperazine
CID 114153752
1-(2-cyclohexylethyl)-5-cyclopropyl-2,5-dimethylpiperazine
CID 64934954
5-cyclopropyl-2,5-dimethyl-1-(4-phenylbutyl)piperazine
CID 114334950
3-[2-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)ethyl]-5-methyl-1,2,4-oxadiazole
CID 106421427
4-(5-cyclopropyl-2,5-dimethylpiperazin-1-yl)-N,N-dimethylbutan-1-amine
CID 64946958
5-cyclopropyl-2,5-dimethyl-1-(5-methylhexyl)piperazine
CID 113287832
5-cyclopropyl-2,5-dimethyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine
CID 64948073
5-cyclopropyl-1-[2-(cyclopropylmethoxy)ethyl]-2,5-dimethylpiperazine
CID 114097818
5-cyclopropyl-1-(3-ethylsulfonylpropyl)-2,5-dimethylpiperazine
CID 65097008

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine?
The IUPAC name of 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine (CID 114153759) is 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine.
What is the SMILES notation for 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine?
The canonical SMILES for 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine is CC1CNC(C)(C2CC2)CN1CCC1=CCCC1.
What is the InChIKey of 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine?
The InChIKey is DCVDTYRVGLORFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2/c1-13-11-17-16(2,15-7-8-15)12-18(13)10-9-14-5-3-4-6-14/h5,13,15,17H,3-4,6-12H2,1-2H3.
What are the key properties of 1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine?
1-[2-(cyclopenten-1-yl)ethyl]-5-cyclopropyl-2,5-dimethylpiperazine has a molecular weight of 248.41 g/mol, XLogP of 2.95, 4 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]-5-cyclopropyl-2,5-dimethylpiperazine is sourced from PubChem (CID 114153759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).