1-but-1-enyl-4-propan-2-ylpiperazine

C11H22N2 — CID 59978229

IUPAC1-but-1-enyl-4-propan-2-ylpiperazine
SMILESCCC=CN1CCN(C(C)C)CC1
InChIInChI=1S/C11H22N2/c1-4-5-6-12-7-9-13(10-8-12)11(2)3/h5-6,11H,4,7-10H2,1-3H3
InChIKeyWUOPLRWMQNISJP-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.94
Rot. Bonds3

About 1-but-1-enyl-4-propan-2-ylpiperazine

1-but-1-enyl-4-propan-2-ylpiperazine (PubChem CID 59978229) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-but-1-enyl-4-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-but-1-enyl-4-propan-2-ylpiperazine
PubChem CID59978229
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-but-1-enyl-4-propan-2-ylpiperazine
SMILESCCC=CN1CCN(C(C)C)CC1
InChIInChI=1S/C11H22N2/c1-4-5-6-12-7-9-13(10-8-12)11(2)3/h5-6,11H,4,7-10H2,1-3H3
InChIKeyWUOPLRWMQNISJP-UHFFFAOYSA-N
XLogP1.94
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 ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Dipropenylpiperazine
CID 134821216
1-[3-(2,3-Dihydropyrrol-1-yl)butan-2-yl]-4-(2,2,2-trifluoroethyl)piperazine
CID 139395078
1-[(1E)-4-fluoropenta-1,4-dienyl]-4-methylpiperazine
CID 142187247
1-Propan-2-yl-4-prop-2-enylpiperazine
CID 20613816
1-[(E)-but-1-enyl]-4-methylpiperazine
CID 15156750
1-[(1E)-1,3-butadienyl]-4-methylpiperazine
CID 15665727
(E)-1-N,1-N,3-N,3-N-tetraethylbut-1-ene-1,3-diamine
CID 10910504
2-Ethenyl-1,4-dimethylpiperazine
CID 14612244
1-But-3-enyl-4-methylpiperazine
CID 20649684
1-methyl-4-[(E)-prop-1-enyl]piperazine
CID 20748422
1-methyl-4-[(Z)-prop-1-enyl]piperazine
CID 57296904
1-Propan-2-yl-4-prop-1-en-2-ylpiperazine
CID 58547477

Frequently Asked Questions

What is the IUPAC name of 1-but-1-enyl-4-propan-2-ylpiperazine?
The IUPAC name of 1-but-1-enyl-4-propan-2-ylpiperazine (CID 59978229) is 1-but-1-enyl-4-propan-2-ylpiperazine.
What is the SMILES notation for 1-but-1-enyl-4-propan-2-ylpiperazine?
The canonical SMILES for 1-but-1-enyl-4-propan-2-ylpiperazine is CCC=CN1CCN(C(C)C)CC1.
What is the InChIKey of 1-but-1-enyl-4-propan-2-ylpiperazine?
The InChIKey is WUOPLRWMQNISJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-4-5-6-12-7-9-13(10-8-12)11(2)3/h5-6,11H,4,7-10H2,1-3H3.
What are the key properties of 1-but-1-enyl-4-propan-2-ylpiperazine?
1-but-1-enyl-4-propan-2-ylpiperazine has a molecular weight of 182.31 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-but-1-enyl-4-propan-2-ylpiperazine is sourced from PubChem (CID 59978229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).