4-methyl-5-methylidene-4H-pyrimidine

C6H8N2 — CID 118123149

IUPAC4-methyl-5-methylidene-4H-pyrimidine
SMILESC=C1C=NC=NC1C
InChIInChI=1S/C6H8N2/c1-5-3-7-4-8-6(5)2/h3-4,6H,1H2,2H3
InChIKeyDOVBJCBQGOWVDX-UHFFFAOYSA-N
MW108.14 g/mol
LogP1.04
Rot. Bonds

About 4-methyl-5-methylidene-4H-pyrimidine

4-methyl-5-methylidene-4H-pyrimidine (PubChem CID 118123149) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is 4-methyl-5-methylidene-4H-pyrimidine.

Molecular Properties

Compound Name4-methyl-5-methylidene-4H-pyrimidine
PubChem CID118123149
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Name4-methyl-5-methylidene-4H-pyrimidine
SMILESC=C1C=NC=NC1C
InChIInChI=1S/C6H8N2/c1-5-3-7-4-8-6(5)2/h3-4,6H,1H2,2H3
InChIKeyDOVBJCBQGOWVDX-UHFFFAOYSA-N
XLogP1.04
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-methyl-5-methylidene-4H-pyrimidine 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 4-methyl-5-methylidene-4H-pyrimidine?
The IUPAC name of 4-methyl-5-methylidene-4H-pyrimidine (CID 118123149) is 4-methyl-5-methylidene-4H-pyrimidine.
What is the SMILES notation for 4-methyl-5-methylidene-4H-pyrimidine?
The canonical SMILES for 4-methyl-5-methylidene-4H-pyrimidine is C=C1C=NC=NC1C.
What is the InChIKey of 4-methyl-5-methylidene-4H-pyrimidine?
The InChIKey is DOVBJCBQGOWVDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c1-5-3-7-4-8-6(5)2/h3-4,6H,1H2,2H3.
What are the key properties of 4-methyl-5-methylidene-4H-pyrimidine?
4-methyl-5-methylidene-4H-pyrimidine has a molecular weight of 108.14 g/mol, XLogP of 1.04, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-methylidene-4H-pyrimidine is sourced from PubChem (CID 118123149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).