5-methoxypyrimidine-2-sulfonamide

C5H7N3O3S — CID 12939900

IUPAC5-methoxypyrimidine-2-sulfonamide
SMILESCOc1cnc(S(N)(=O)=O)nc1
InChIInChI=1S/C5H7N3O3S/c1-11-4-2-7-5(8-3-4)12(6,9)10/h2-3H,1H3,(H2,6,9,10)
InChIKeyKTTKYVUHTLTIME-UHFFFAOYSA-N
MW189.20 g/mol
LogP-0.87
Rot. Bonds2

About 5-methoxypyrimidine-2-sulfonamide

5-methoxypyrimidine-2-sulfonamide (PubChem CID 12939900) has the molecular formula C5H7N3O3S and a molecular weight of 189.20 g/mol. Its IUPAC name is 5-methoxypyrimidine-2-sulfonamide.

Molecular Properties

Compound Name5-methoxypyrimidine-2-sulfonamide
PubChem CID12939900
Molecular FormulaC5H7N3O3S
Molecular Weight189.20 g/mol
Exact Mass189.02
IUPAC Name5-methoxypyrimidine-2-sulfonamide
SMILESCOc1cnc(S(N)(=O)=O)nc1
InChIInChI=1S/C5H7N3O3S/c1-11-4-2-7-5(8-3-4)12(6,9)10/h2-3H,1H3,(H2,6,9,10)
InChIKeyKTTKYVUHTLTIME-UHFFFAOYSA-N
XLogP-0.87
TPSA95.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.20
LogP ≤ 5-0.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxypyrimidine-2-sulfonamide?
The IUPAC name of 5-methoxypyrimidine-2-sulfonamide (CID 12939900) is 5-methoxypyrimidine-2-sulfonamide.
What is the SMILES notation for 5-methoxypyrimidine-2-sulfonamide?
The canonical SMILES for 5-methoxypyrimidine-2-sulfonamide is COc1cnc(S(N)(=O)=O)nc1.
What is the InChIKey of 5-methoxypyrimidine-2-sulfonamide?
The InChIKey is KTTKYVUHTLTIME-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O3S/c1-11-4-2-7-5(8-3-4)12(6,9)10/h2-3H,1H3,(H2,6,9,10).
What are the key properties of 5-methoxypyrimidine-2-sulfonamide?
5-methoxypyrimidine-2-sulfonamide has a molecular weight of 189.20 g/mol, XLogP of -0.87, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxypyrimidine-2-sulfonamide is sourced from PubChem (CID 12939900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).