1,3-dimethyl-2,4-dihydropyrimidine

C6H12N2 — CID 19432557

IUPAC1,3-dimethyl-2,4-dihydropyrimidine
SMILESCN1C=CCN(C)C1
InChIInChI=1S/C6H12N2/c1-7-4-3-5-8(2)6-7/h3-4H,5-6H2,1-2H3
InChIKeyUPCMWHVBPPBFPF-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.33
Rot. Bonds

About 1,3-dimethyl-2,4-dihydropyrimidine

1,3-dimethyl-2,4-dihydropyrimidine (PubChem CID 19432557) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 1,3-dimethyl-2,4-dihydropyrimidine.

Molecular Properties

Compound Name1,3-dimethyl-2,4-dihydropyrimidine
PubChem CID19432557
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name1,3-dimethyl-2,4-dihydropyrimidine
SMILESCN1C=CCN(C)C1
InChIInChI=1S/C6H12N2/c1-7-4-3-5-8(2)6-7/h3-4H,5-6H2,1-2H3
InChIKeyUPCMWHVBPPBFPF-UHFFFAOYSA-N
XLogP0.33
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,3-dimethyl-2,4-dihydropyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Allyl-3-methyl imidazole
CID 19927377
1-Allyl-3-vinylimidazole
CID 23154610
1-ethyl-3-prop-2-enyl-2H-imidazole
CID 23154613
1-prop-2-enyl-3-propyl-2H-imidazole
CID 23154622
Methyltetrahydropyrimidinamin
CID 129646687
6-Amino-1,3-dimethylpyrimidine
CID 129856101
2,2-difluoro-1,3-dimethyl-4H-pyrimidine
CID 22987208
2-Fluoro-1,3-dimethyl-2,4-dihydropyrimidine
CID 150760065
5-Fluoro-1,3-dimethyl-2,4-dihydropyrimidine
CID 162353023
1-Methyl-3-(trifluoromethyl)-2,4-dihydropyrimidine
CID 173862446
2-fluoro-1-methyl-3-prop-2-enyl-2H-imidazole
CID 175194676
1,3-Dibutyl-2,4-dihydropyrimidine
CID 226446

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2,4-dihydropyrimidine?
The IUPAC name of 1,3-dimethyl-2,4-dihydropyrimidine (CID 19432557) is 1,3-dimethyl-2,4-dihydropyrimidine.
What is the SMILES notation for 1,3-dimethyl-2,4-dihydropyrimidine?
The canonical SMILES for 1,3-dimethyl-2,4-dihydropyrimidine is CN1C=CCN(C)C1.
What is the InChIKey of 1,3-dimethyl-2,4-dihydropyrimidine?
The InChIKey is UPCMWHVBPPBFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-7-4-3-5-8(2)6-7/h3-4H,5-6H2,1-2H3.
What are the key properties of 1,3-dimethyl-2,4-dihydropyrimidine?
1,3-dimethyl-2,4-dihydropyrimidine has a molecular weight of 112.18 g/mol, XLogP of 0.33, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2,4-dihydropyrimidine is sourced from PubChem (CID 19432557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).