(5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine

C11H14N2 — CID 89385025

IUPAC(5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine
SMILESC/C=C\C=c1\cncnc1=C(C)C
InChIInChI=1S/C11H14N2/c1-4-5-6-10-7-12-8-13-11(10)9(2)3/h4-8H,1-3H3/b5-4-,10-6-
InChIKeyZMHXIWSBLJWHBI-ARSRRCBKSA-N
MW174.25 g/mol
LogP1.02
Rot. Bonds1

About (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine

(5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine (PubChem CID 89385025) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine.

Molecular Properties

Compound Name(5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine
PubChem CID89385025
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name(5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine
SMILESC/C=C\C=c1\cncnc1=C(C)C
InChIInChI=1S/C11H14N2/c1-4-5-6-10-7-12-8-13-11(10)9(2)3/h4-8H,1-3H3/b5-4-,10-6-
InChIKeyZMHXIWSBLJWHBI-ARSRRCBKSA-N
XLogP1.02
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine 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 (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine?
The IUPAC name of (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine (CID 89385025) is (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine.
What is the SMILES notation for (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine?
The canonical SMILES for (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine is C/C=C\C=c1\cncnc1=C(C)C.
What is the InChIKey of (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine?
The InChIKey is ZMHXIWSBLJWHBI-ARSRRCBKSA-N. The full InChI is InChI=1S/C11H14N2/c1-4-5-6-10-7-12-8-13-11(10)9(2)3/h4-8H,1-3H3/b5-4-,10-6-.
What are the key properties of (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine?
(5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine has a molecular weight of 174.25 g/mol, XLogP of 1.02, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-5-[(Z)-but-2-enylidene]-4-propan-2-ylidenepyrimidine is sourced from PubChem (CID 89385025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).