1-methyl-6-methylidene-4,5-dihydropyrimidine

C6H10N2 — CID 91610482

IUPAC1-methyl-6-methylidene-4,5-dihydropyrimidine
SMILESC=C1CCN=CN1C
InChIInChI=1S/C6H10N2/c1-6-3-4-7-5-8(6)2/h5H,1,3-4H2,2H3
InChIKeyZJTSYPVPOZYQMS-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.86
Rot. Bonds

About 1-methyl-6-methylidene-4,5-dihydropyrimidine

1-methyl-6-methylidene-4,5-dihydropyrimidine (PubChem CID 91610482) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 1-methyl-6-methylidene-4,5-dihydropyrimidine.

Molecular Properties

Compound Name1-methyl-6-methylidene-4,5-dihydropyrimidine
PubChem CID91610482
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name1-methyl-6-methylidene-4,5-dihydropyrimidine
SMILESC=C1CCN=CN1C
InChIInChI=1S/C6H10N2/c1-6-3-4-7-5-8(6)2/h5H,1,3-4H2,2H3
InChIKeyZJTSYPVPOZYQMS-UHFFFAOYSA-N
XLogP0.86
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-6-methylidene-4,5-dihydropyrimidine?
The IUPAC name of 1-methyl-6-methylidene-4,5-dihydropyrimidine (CID 91610482) is 1-methyl-6-methylidene-4,5-dihydropyrimidine.
What is the SMILES notation for 1-methyl-6-methylidene-4,5-dihydropyrimidine?
The canonical SMILES for 1-methyl-6-methylidene-4,5-dihydropyrimidine is C=C1CCN=CN1C.
What is the InChIKey of 1-methyl-6-methylidene-4,5-dihydropyrimidine?
The InChIKey is ZJTSYPVPOZYQMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-6-3-4-7-5-8(6)2/h5H,1,3-4H2,2H3.
What are the key properties of 1-methyl-6-methylidene-4,5-dihydropyrimidine?
1-methyl-6-methylidene-4,5-dihydropyrimidine has a molecular weight of 110.16 g/mol, XLogP of 0.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-6-methylidene-4,5-dihydropyrimidine is sourced from PubChem (CID 91610482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).