4,5-dimethyl-1,4-dihydropyrimidine

C6H10N2 — CID 57275033

IUPAC4,5-dimethyl-1,4-dihydropyrimidine
SMILESCC1=CNC=NC1C
InChIInChI=1S/C6H10N2/c1-5-3-7-4-8-6(5)2/h3-4,6H,1-2H3,(H,7,8)
InChIKeyCXMLAEDLECHSOY-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.91
Rot. Bonds

About 4,5-dimethyl-1,4-dihydropyrimidine

4,5-dimethyl-1,4-dihydropyrimidine (PubChem CID 57275033) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 4,5-dimethyl-1,4-dihydropyrimidine.

Molecular Properties

Compound Name4,5-dimethyl-1,4-dihydropyrimidine
PubChem CID57275033
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name4,5-dimethyl-1,4-dihydropyrimidine
SMILESCC1=CNC=NC1C
InChIInChI=1S/C6H10N2/c1-5-3-7-4-8-6(5)2/h3-4,6H,1-2H3,(H,7,8)
InChIKeyCXMLAEDLECHSOY-UHFFFAOYSA-N
XLogP0.91
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1,4-dihydropyrimidine?
The IUPAC name of 4,5-dimethyl-1,4-dihydropyrimidine (CID 57275033) is 4,5-dimethyl-1,4-dihydropyrimidine.
What is the SMILES notation for 4,5-dimethyl-1,4-dihydropyrimidine?
The canonical SMILES for 4,5-dimethyl-1,4-dihydropyrimidine is CC1=CNC=NC1C.
What is the InChIKey of 4,5-dimethyl-1,4-dihydropyrimidine?
The InChIKey is CXMLAEDLECHSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-5-3-7-4-8-6(5)2/h3-4,6H,1-2H3,(H,7,8).
What are the key properties of 4,5-dimethyl-1,4-dihydropyrimidine?
4,5-dimethyl-1,4-dihydropyrimidine has a molecular weight of 110.16 g/mol, XLogP of 0.91, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-1,4-dihydropyrimidine is sourced from PubChem (CID 57275033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).