(3Z)-3-propylidenepyridin-2-imine

C8H10N2 — CID 134511042

IUPAC(3Z)-3-propylidenepyridin-2-imine
SMILES[H]/N=C1\N=CC=C\C1=C\CC
InChIInChI=1S/C8H10N2/c1-2-4-7-5-3-6-10-8(7)9/h3-6,9H,2H2,1H3/b7-4-,9-8-
InChIKeyWTCJKFJESVPUNI-UHWGBUKQSA-N
MW134.18 g/mol
LogP1.94
Rot. Bonds1

About (3Z)-3-propylidenepyridin-2-imine

(3Z)-3-propylidenepyridin-2-imine (PubChem CID 134511042) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is (3Z)-3-propylidenepyridin-2-imine.

Molecular Properties

Compound Name(3Z)-3-propylidenepyridin-2-imine
PubChem CID134511042
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name(3Z)-3-propylidenepyridin-2-imine
SMILES[H]/N=C1\N=CC=C\C1=C\CC
InChIInChI=1S/C8H10N2/c1-2-4-7-5-3-6-10-8(7)9/h3-6,9H,2H2,1H3/b7-4-,9-8-
InChIKeyWTCJKFJESVPUNI-UHWGBUKQSA-N
XLogP1.94
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (3Z)-3-propylidenepyridin-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 (3Z)-3-propylidenepyridin-2-imine?
The IUPAC name of (3Z)-3-propylidenepyridin-2-imine (CID 134511042) is (3Z)-3-propylidenepyridin-2-imine.
What is the SMILES notation for (3Z)-3-propylidenepyridin-2-imine?
The canonical SMILES for (3Z)-3-propylidenepyridin-2-imine is [H]/N=C1\N=CC=C\C1=C\CC.
What is the InChIKey of (3Z)-3-propylidenepyridin-2-imine?
The InChIKey is WTCJKFJESVPUNI-UHWGBUKQSA-N. The full InChI is InChI=1S/C8H10N2/c1-2-4-7-5-3-6-10-8(7)9/h3-6,9H,2H2,1H3/b7-4-,9-8-.
What are the key properties of (3Z)-3-propylidenepyridin-2-imine?
(3Z)-3-propylidenepyridin-2-imine has a molecular weight of 134.18 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-propylidenepyridin-2-imine is sourced from PubChem (CID 134511042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).