N-(5-methoxypyrimidin-2-yl)methanesulfonamide

C6H9N3O3S — CID 130651908

IUPACN-(5-methoxypyrimidin-2-yl)methanesulfonamide
SMILESCOc1cnc(NS(C)(=O)=O)nc1
InChIInChI=1S/C6H9N3O3S/c1-12-5-3-7-6(8-4-5)9-13(2,10)11/h3-4H,1-2H3,(H,7,8,9)
InChIKeyXPCIDLMHPDEIRP-UHFFFAOYSA-N
MW203.22 g/mol
LogP-0.14
Rot. Bonds3

About N-(5-methoxypyrimidin-2-yl)methanesulfonamide

N-(5-methoxypyrimidin-2-yl)methanesulfonamide (PubChem CID 130651908) has the molecular formula C6H9N3O3S and a molecular weight of 203.22 g/mol. Its IUPAC name is N-(5-methoxypyrimidin-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(5-methoxypyrimidin-2-yl)methanesulfonamide
PubChem CID130651908
Molecular FormulaC6H9N3O3S
Molecular Weight203.22 g/mol
Exact Mass203.04
IUPAC NameN-(5-methoxypyrimidin-2-yl)methanesulfonamide
SMILESCOc1cnc(NS(C)(=O)=O)nc1
InChIInChI=1S/C6H9N3O3S/c1-12-5-3-7-6(8-4-5)9-13(2,10)11/h3-4H,1-2H3,(H,7,8,9)
InChIKeyXPCIDLMHPDEIRP-UHFFFAOYSA-N
XLogP-0.14
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.22
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methoxy-2-pyridinyl)methanesulfonamide
CID 67233634
N-[5-(1-hydroxyethyl)pyrimidin-2-yl]methanesulfonamide
CID 71230504
4-amino-N-(5-methoxypyrimidin-2-yl)benzenesulfonamide;hydrate
CID 45052589
4-amino-2,3,5,6-tetradeuterio-N-(5-methoxypyrimidin-2-yl)benzenesulfonamide
CID 46782959
5-methoxypyrimidine-2-sulfonamide
CID 12939900
2-chloro-N-[4-[(5-methoxypyrimidin-2-yl)sulfamoyl]phenyl]acetamide
CID 132531856
N-(5-methoxypyrimidin-2-yl)-3-propanoylbenzenesulfonamide
CID 122157515
N-(5-bromo-4-methylpyrimidin-2-yl)methanesulfonamide
CID 67280006
4-(5-formylfuran-2-yl)-N-(5-methoxypyrimidin-2-yl)benzenesulfonamide
CID 169336206
ethyl N-(5-methoxypyrimidin-2-yl)carbamate
CID 4159152
2-bromo-N-(5-methoxypyrimidin-2-yl)propanamide
CID 4658979
5-methoxy-2-methyl-3-methylsulfonylpyridine
CID 167144951

Frequently Asked Questions

What is the IUPAC name of N-(5-methoxypyrimidin-2-yl)methanesulfonamide?
The IUPAC name of N-(5-methoxypyrimidin-2-yl)methanesulfonamide (CID 130651908) is N-(5-methoxypyrimidin-2-yl)methanesulfonamide.
What is the SMILES notation for N-(5-methoxypyrimidin-2-yl)methanesulfonamide?
The canonical SMILES for N-(5-methoxypyrimidin-2-yl)methanesulfonamide is COc1cnc(NS(C)(=O)=O)nc1.
What is the InChIKey of N-(5-methoxypyrimidin-2-yl)methanesulfonamide?
The InChIKey is XPCIDLMHPDEIRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O3S/c1-12-5-3-7-6(8-4-5)9-13(2,10)11/h3-4H,1-2H3,(H,7,8,9).
What are the key properties of N-(5-methoxypyrimidin-2-yl)methanesulfonamide?
N-(5-methoxypyrimidin-2-yl)methanesulfonamide has a molecular weight of 203.22 g/mol, XLogP of -0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methoxypyrimidin-2-yl)methanesulfonamide is sourced from PubChem (CID 130651908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).