1-methyl-4-(2-methylpent-2-enyl)piperazine

C11H22N2 — CID 123791739

IUPAC1-methyl-4-(2-methylpent-2-enyl)piperazine
SMILESCCC=C(C)CN1CCN(C)CC1
InChIInChI=1S/C11H22N2/c1-4-5-11(2)10-13-8-6-12(3)7-9-13/h5H,4,6-10H2,1-3H3
InChIKeyQXTCPCKZLVADLJ-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.59
Rot. Bonds3

About 1-methyl-4-(2-methylpent-2-enyl)piperazine

1-methyl-4-(2-methylpent-2-enyl)piperazine (PubChem CID 123791739) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-methyl-4-(2-methylpent-2-enyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(2-methylpent-2-enyl)piperazine
PubChem CID123791739
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-methyl-4-(2-methylpent-2-enyl)piperazine
SMILESCCC=C(C)CN1CCN(C)CC1
InChIInChI=1S/C11H22N2/c1-4-5-11(2)10-13-8-6-12(3)7-9-13/h5H,4,6-10H2,1-3H3
InChIKeyQXTCPCKZLVADLJ-UHFFFAOYSA-N
XLogP1.59
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,5-Diethyl-1,2,3,6-tetrahydropyridine
CID 641110
Piperazine, 1,4-bis(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
CID 6446208
Piperazine, 1-allyl-4-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
CID 6446858
Cambridge id 5513707
CID 870776
Cambridge id 5513711
CID 870777
1,4-Bis(2-methylprop-2-enyl)piperazine
CID 2047144
1-[2-Ethylidene-3-(trifluoromethyl)pent-3-enyl]-4-methylpiperazine
CID 123401847
1-Methyl-4-[2-(1,1,1-trifluoropropan-2-ylidene)pent-3-enyl]piperazine
CID 123611666
1-Ethyl-4-[2-(2,2,2-trifluoroethyl)but-2-enyl]piperazine
CID 123724920
1-Methyl-4-[2-(3,3,3-trifluoroprop-1-en-2-yl)but-2-enyl]piperazine
CID 123958710
1-[(2Z)-2-[(E)-1-fluoroprop-1-enyl]penta-2,4-dienyl]-4-methylpiperazine
CID 129043271
1-[(E,2E)-2-ethylidene-4-fluorohex-3-enyl]-4-methylpiperazine
CID 144191887

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-methylpent-2-enyl)piperazine?
The IUPAC name of 1-methyl-4-(2-methylpent-2-enyl)piperazine (CID 123791739) is 1-methyl-4-(2-methylpent-2-enyl)piperazine.
What is the SMILES notation for 1-methyl-4-(2-methylpent-2-enyl)piperazine?
The canonical SMILES for 1-methyl-4-(2-methylpent-2-enyl)piperazine is CCC=C(C)CN1CCN(C)CC1.
What is the InChIKey of 1-methyl-4-(2-methylpent-2-enyl)piperazine?
The InChIKey is QXTCPCKZLVADLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-4-5-11(2)10-13-8-6-12(3)7-9-13/h5H,4,6-10H2,1-3H3.
What are the key properties of 1-methyl-4-(2-methylpent-2-enyl)piperazine?
1-methyl-4-(2-methylpent-2-enyl)piperazine has a molecular weight of 182.31 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-methylpent-2-enyl)piperazine is sourced from PubChem (CID 123791739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).