4,6-dimethylpyrimidine-2-sulfonamide

C6H9N3O2S — CID 22244676

IUPAC4,6-dimethylpyrimidine-2-sulfonamide
SMILESCc1cc(C)nc(S(N)(=O)=O)n1
InChIInChI=1S/C6H9N3O2S/c1-4-3-5(2)9-6(8-4)12(7,10)11/h3H,1-2H3,(H2,7,10,11)
InChIKeyJRDPRXWPTQTRLO-UHFFFAOYSA-N
MW187.22 g/mol
LogP-0.26
Rot. Bonds1

About 4,6-dimethylpyrimidine-2-sulfonamide

4,6-dimethylpyrimidine-2-sulfonamide (PubChem CID 22244676) has the molecular formula C6H9N3O2S and a molecular weight of 187.22 g/mol. Its IUPAC name is 4,6-dimethylpyrimidine-2-sulfonamide.

Molecular Properties

Compound Name4,6-dimethylpyrimidine-2-sulfonamide
PubChem CID22244676
Molecular FormulaC6H9N3O2S
Molecular Weight187.22 g/mol
Exact Mass187.04
IUPAC Name4,6-dimethylpyrimidine-2-sulfonamide
SMILESCc1cc(C)nc(S(N)(=O)=O)n1
InChIInChI=1S/C6H9N3O2S/c1-4-3-5(2)9-6(8-4)12(7,10)11/h3H,1-2H3,(H2,7,10,11)
InChIKeyJRDPRXWPTQTRLO-UHFFFAOYSA-N
XLogP-0.26
TPSA85.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.22
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4,6-dimethylpyrimidine-2-sulfonamide 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

2-Amino-4,6-dimethyl pyrimidine
CID 13021
4,6-Dimethylpyrimidin-2-ylthiourea
CID 747500
4,6-Dimethyl-2-(methylsulfanyl)pyrimidine
CID 12343174
2-(2-Ethanesulfonyl-ethylsulfanyl)-4,6-dimethyl-pyrimidine
CID 656348
Butan-2-one O-(4,6-dimethyl-pyrimidin-2-yl)-oxime
CID 5421395
(4,6-Dimethylpyrimidin-2-yl)cyanamide
CID 521618
4,6-Dimethyl-2-methylsulfonylpyrimidine
CID 2772382
4,6-Dimethylpyrimidine-2-sulfonyl fluoride
CID 14404718
2-Methoxy-4,6-dimethylpyrimidine
CID 11428264
4,6-Dimethylpyrimidin-2-yl thiocyanate
CID 3043121
2-Mercapto-4,6-dimethylpyrimidine-sodiumsalt
CID 23669009
2-[(Difluoromethyl)sulfanyl]-4,6-dimethylpyrimidine
CID 911696

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethylpyrimidine-2-sulfonamide?
The IUPAC name of 4,6-dimethylpyrimidine-2-sulfonamide (CID 22244676) is 4,6-dimethylpyrimidine-2-sulfonamide.
What is the SMILES notation for 4,6-dimethylpyrimidine-2-sulfonamide?
The canonical SMILES for 4,6-dimethylpyrimidine-2-sulfonamide is Cc1cc(C)nc(S(N)(=O)=O)n1.
What is the InChIKey of 4,6-dimethylpyrimidine-2-sulfonamide?
The InChIKey is JRDPRXWPTQTRLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2S/c1-4-3-5(2)9-6(8-4)12(7,10)11/h3H,1-2H3,(H2,7,10,11).
What are the key properties of 4,6-dimethylpyrimidine-2-sulfonamide?
4,6-dimethylpyrimidine-2-sulfonamide has a molecular weight of 187.22 g/mol, XLogP of -0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethylpyrimidine-2-sulfonamide is sourced from PubChem (CID 22244676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).