(E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine

C9H18N2 — CID 67892212

IUPAC(E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine
SMILESC/C=C(\N)N1CCC(C)CC1
InChIInChI=1S/C9H18N2/c1-3-9(10)11-6-4-8(2)5-7-11/h3,8H,4-7,10H2,1-2H3/b9-3+
InChIKeyZVCDAWCUFSLPNS-YCRREMRBSA-N
MW154.26 g/mol
LogP1.54
Rot. Bonds1

About (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine

(E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine (PubChem CID 67892212) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine.

Molecular Properties

Compound Name(E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine
PubChem CID67892212
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine
SMILESC/C=C(\N)N1CCC(C)CC1
InChIInChI=1S/C9H18N2/c1-3-9(10)11-6-4-8(2)5-7-11/h3,8H,4-7,10H2,1-2H3/b9-3+
InChIKeyZVCDAWCUFSLPNS-YCRREMRBSA-N
XLogP1.54
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine?
The IUPAC name of (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine (CID 67892212) is (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine.
What is the SMILES notation for (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine?
The canonical SMILES for (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine is C/C=C(\N)N1CCC(C)CC1.
What is the InChIKey of (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine?
The InChIKey is ZVCDAWCUFSLPNS-YCRREMRBSA-N. The full InChI is InChI=1S/C9H18N2/c1-3-9(10)11-6-4-8(2)5-7-11/h3,8H,4-7,10H2,1-2H3/b9-3+.
What are the key properties of (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine?
(E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine has a molecular weight of 154.26 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(4-methylpiperidin-1-yl)prop-1-en-1-amine is sourced from PubChem (CID 67892212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).