1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine

C13H25N3 — CID 117269290

IUPAC1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine
SMILESCN1CCCC(/C=C\CN2CCNCC2)C1
InChIInChI=1S/C13H25N3/c1-15-8-2-4-13(12-15)5-3-9-16-10-6-14-7-11-16/h3,5,13-14H,2,4,6-12H2,1H3/b5-3-
InChIKeyRRUQLXPTCWMRET-HYXAFXHYSA-N
MW223.36 g/mol
LogP0.79
Rot. Bonds3

About 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine

1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine (PubChem CID 117269290) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine.

Molecular Properties

Compound Name1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine
PubChem CID117269290
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC Name1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine
SMILESCN1CCCC(/C=C\CN2CCNCC2)C1
InChIInChI=1S/C13H25N3/c1-15-8-2-4-13(12-15)5-3-9-16-10-6-14-7-11-16/h3,5,13-14H,2,4,6-12H2,1H3/b5-3-
InChIKeyRRUQLXPTCWMRET-HYXAFXHYSA-N
XLogP0.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Z)-N-methyl-4-(1-methylpiperidin-3-yl)but-3-en-1-amine
CID 117267511
(Z)-4-(1-methylpiperidin-3-yl)but-3-enoic acid
CID 117267539
1-(1-methylpiperidin-3-yl)-3-piperazin-1-ylpropan-1-one
CID 116918923
1-[(E)-3-cyclopropylprop-2-enyl]-3-methyl-1,4-diazepane
CID 131234517
N-methyl-1-(1-methylpiperidin-4-yl)-N-(piperazin-1-ylmethyl)methanamine
CID 115230110
2-(1,4-diazepan-1-yl)-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]ethanamine
CID 63274337
N-(1-methylpiperidin-3-yl)-2-piperazin-1-ylacetamide
CID 61212006
3-[(Z)-4-piperazin-1-ylbut-2-enyl]thiolane 1,1-dioxide
CID 117269273
N-methyl-N-[(1-methylpiperidin-4-yl)methyl]-2-piperazin-1-ylethanamine
CID 63236887
N,1-dimethyl-N-(piperidin-4-ylmethyl)piperidin-3-amine
CID 62546416
N-methyl-N-[(1-methylpiperidin-3-yl)methyl]piperidin-4-amine
CID 115118418
N-(cyclobutylmethyl)-N-methyl-2-piperazin-1-ylethanamine
CID 62860620

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine?
The IUPAC name of 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine (CID 117269290) is 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine.
What is the SMILES notation for 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine?
The canonical SMILES for 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine is CN1CCCC(/C=C\CN2CCNCC2)C1.
What is the InChIKey of 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine?
The InChIKey is RRUQLXPTCWMRET-HYXAFXHYSA-N. The full InChI is InChI=1S/C13H25N3/c1-15-8-2-4-13(12-15)5-3-9-16-10-6-14-7-11-16/h3,5,13-14H,2,4,6-12H2,1H3/b5-3-.
What are the key properties of 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine?
1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine has a molecular weight of 223.36 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-3-(1-methylpiperidin-3-yl)prop-2-enyl]piperazine is sourced from PubChem (CID 117269290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).