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

C6H8N2 — CID 130455690

IUPAC6-methyl-5-methylidene-4H-pyrimidine
SMILESC=C1CN=CN=C1C
InChIInChI=1S/C6H8N2/c1-5-3-7-4-8-6(5)2/h4H,1,3H2,2H3
InChIKeyWTKMITNWHBZGCP-UHFFFAOYSA-N
MW108.14 g/mol
LogP1.05
Rot. Bonds

About 6-methyl-5-methylidene-4H-pyrimidine

6-methyl-5-methylidene-4H-pyrimidine (PubChem CID 130455690) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is 6-methyl-5-methylidene-4H-pyrimidine.

Molecular Properties

Compound Name6-methyl-5-methylidene-4H-pyrimidine
PubChem CID130455690
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Name6-methyl-5-methylidene-4H-pyrimidine
SMILESC=C1CN=CN=C1C
InChIInChI=1S/C6H8N2/c1-5-3-7-4-8-6(5)2/h4H,1,3H2,2H3
InChIKeyWTKMITNWHBZGCP-UHFFFAOYSA-N
XLogP1.05
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 ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-dimethyl-5-methylidene-4H-pyrimidine
CID 91080340
4-methyl-5-methylidene-4H-pyrimidine
CID 118123149
ethane;N'-ethyl-N-(3-methylbut-3-en-2-ylidene)methanimidamide
CID 142218579
ethane;N-(3-methylbut-3-en-2-ylidene)-N'-propan-2-ylmethanimidamide
CID 142218592
6-Prop-1-en-2-yl-4,5-dihydropyrimidine
CID 155049734
N'-ethyl-N-(3-methylbut-3-en-2-ylidene)methanimidamide
CID 142218580
N-(3-methylbut-3-en-2-ylidene)-N'-propan-2-ylmethanimidamide
CID 142218593

Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-methylidene-4H-pyrimidine?
The IUPAC name of 6-methyl-5-methylidene-4H-pyrimidine (CID 130455690) is 6-methyl-5-methylidene-4H-pyrimidine.
What is the SMILES notation for 6-methyl-5-methylidene-4H-pyrimidine?
The canonical SMILES for 6-methyl-5-methylidene-4H-pyrimidine is C=C1CN=CN=C1C.
What is the InChIKey of 6-methyl-5-methylidene-4H-pyrimidine?
The InChIKey is WTKMITNWHBZGCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c1-5-3-7-4-8-6(5)2/h4H,1,3H2,2H3.
What are the key properties of 6-methyl-5-methylidene-4H-pyrimidine?
6-methyl-5-methylidene-4H-pyrimidine has a molecular weight of 108.14 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-methylidene-4H-pyrimidine is sourced from PubChem (CID 130455690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).