4,5-dimethyl-4,5-dihydropyrimidine

C6H10N2 — CID 21336455

IUPAC4,5-dimethyl-4,5-dihydropyrimidine
SMILESCC1C=NC=NC1C
InChIInChI=1S/C6H10N2/c1-5-3-7-4-8-6(5)2/h3-6H,1-2H3
InChIKeyRWRVGIDHYRIHIY-UHFFFAOYSA-N
MW110.16 g/mol
LogP1.12
Rot. Bonds

About 4,5-dimethyl-4,5-dihydropyrimidine

4,5-dimethyl-4,5-dihydropyrimidine (PubChem CID 21336455) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 4,5-dimethyl-4,5-dihydropyrimidine.

Molecular Properties

Compound Name4,5-dimethyl-4,5-dihydropyrimidine
PubChem CID21336455
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name4,5-dimethyl-4,5-dihydropyrimidine
SMILESCC1C=NC=NC1C
InChIInChI=1S/C6H10N2/c1-5-3-7-4-8-6(5)2/h3-6H,1-2H3
InChIKeyRWRVGIDHYRIHIY-UHFFFAOYSA-N
XLogP1.12
TPSA24.72 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 ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-4,5-dihydropyrimidine?
The IUPAC name of 4,5-dimethyl-4,5-dihydropyrimidine (CID 21336455) is 4,5-dimethyl-4,5-dihydropyrimidine.
What is the SMILES notation for 4,5-dimethyl-4,5-dihydropyrimidine?
The canonical SMILES for 4,5-dimethyl-4,5-dihydropyrimidine is CC1C=NC=NC1C.
What is the InChIKey of 4,5-dimethyl-4,5-dihydropyrimidine?
The InChIKey is RWRVGIDHYRIHIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-5-3-7-4-8-6(5)2/h3-6H,1-2H3.
What are the key properties of 4,5-dimethyl-4,5-dihydropyrimidine?
4,5-dimethyl-4,5-dihydropyrimidine has a molecular weight of 110.16 g/mol, XLogP of 1.12, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-4,5-dihydropyrimidine is sourced from PubChem (CID 21336455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).