N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide

C7H11N3O2S — CID 5157234

IUPACN-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide
SMILESCc1cc(C)nc(NS(C)(=O)=O)n1
InChIInChI=1S/C7H11N3O2S/c1-5-4-6(2)9-7(8-5)10-13(3,11)12/h4H,1-3H3,(H,8,9,10)
InChIKeyIAFWOKATFUMIGU-UHFFFAOYSA-N
MW201.25 g/mol
LogP0.46
Rot. Bonds2

About N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide

N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide (PubChem CID 5157234) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide
PubChem CID5157234
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide
SMILESCc1cc(C)nc(NS(C)(=O)=O)n1
InChIInChI=1S/C7H11N3O2S/c1-5-4-6(2)9-7(8-5)10-13(3,11)12/h4H,1-3H3,(H,8,9,10)
InChIKeyIAFWOKATFUMIGU-UHFFFAOYSA-N
XLogP0.46
TPSA71.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-dimethyl-4-pyridinyl)methanesulfonamide
CID 130662680
N-[1-[(4,6-dimethylpyrimidin-2-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 63859356
N-(4,6-dimethylpyrimidin-2-yl)-4,6-dimethylpyrimidin-2-amine
CID 155453170
N-(4,6-dimethylpyrimidin-2-yl)-4-methoxybenzenesulfonamide
CID 717519
5-amino-N-(4,6-dimethylpyrimidin-2-yl)-3-fluoro-2-methylbenzenesulfonamide
CID 79898902
4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;sulfuric acid
CID 21393658
N-(4,6-dimethylpyrimidin-2-yl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 43507234
N-(3-cyano-4,6-dimethyl-2-pyridinyl)methanesulfonamide
CID 59939151
N-(4,6-dimethylpyrimidin-2-yl)-4-ethoxybenzenesulfonamide
CID 22202469
3-bromo-N-(4,6-dimethylpyrimidin-2-yl)thiophene-2-sulfonamide
CID 54951923
N-(4,6-dimethylpyrimidin-2-yl)hydroxylamine
CID 13144367
4-(cyanomethyl)-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
CID 79186466

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide (CID 5157234) is N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide is Cc1cc(C)nc(NS(C)(=O)=O)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide?
The InChIKey is IAFWOKATFUMIGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-5-4-6(2)9-7(8-5)10-13(3,11)12/h4H,1-3H3,(H,8,9,10).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide?
N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide has a molecular weight of 201.25 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)methanesulfonamide is sourced from PubChem (CID 5157234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).