(Z)-N-methylpent-3-en-2-imine

C6H11N — CID 59451924

IUPAC(Z)-N-methylpent-3-en-2-imine
SMILESC/C=C\C(C)=N\C
InChIInChI=1S/C6H11N/c1-4-5-6(2)7-3/h4-5H,1-3H3/b5-4-,7-6+
InChIKeyYELPSSWXBRKTMW-SCFJQAPRSA-N
MW97.16 g/mol
LogP1.65
Rot. Bonds1

About (Z)-N-methylpent-3-en-2-imine

(Z)-N-methylpent-3-en-2-imine (PubChem CID 59451924) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is (Z)-N-methylpent-3-en-2-imine.

Molecular Properties

Compound Name(Z)-N-methylpent-3-en-2-imine
PubChem CID59451924
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Name(Z)-N-methylpent-3-en-2-imine
SMILESC/C=C\C(C)=N\C
InChIInChI=1S/C6H11N/c1-4-5-6(2)7-3/h4-5H,1-3H3/b5-4-,7-6+
InChIKeyYELPSSWXBRKTMW-SCFJQAPRSA-N
XLogP1.65
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze (Z)-N-methylpent-3-en-2-imine 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 (Z)-N-methylpent-3-en-2-imine?
The IUPAC name of (Z)-N-methylpent-3-en-2-imine (CID 59451924) is (Z)-N-methylpent-3-en-2-imine.
What is the SMILES notation for (Z)-N-methylpent-3-en-2-imine?
The canonical SMILES for (Z)-N-methylpent-3-en-2-imine is C/C=C\C(C)=N\C.
What is the InChIKey of (Z)-N-methylpent-3-en-2-imine?
The InChIKey is YELPSSWXBRKTMW-SCFJQAPRSA-N. The full InChI is InChI=1S/C6H11N/c1-4-5-6(2)7-3/h4-5H,1-3H3/b5-4-,7-6+.
What are the key properties of (Z)-N-methylpent-3-en-2-imine?
(Z)-N-methylpent-3-en-2-imine has a molecular weight of 97.16 g/mol, XLogP of 1.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-methylpent-3-en-2-imine is sourced from PubChem (CID 59451924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).