2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide

C11H11FN4O2S — CID 62143731

IUPAC2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
SMILESCc1ccc(F)c(NS(=O)(=O)c2cnc(N)nc2)c1
InChIInChI=1S/C11H11FN4O2S/c1-7-2-3-9(12)10(4-7)16-19(17,18)8-5-14-11(13)15-6-8/h2-6,16H,1H3,(H2,13,14,15)
InChIKeyVARQHJMUPNORPO-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.31
Rot. Bonds3

About 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide

2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide (PubChem CID 62143731) has the molecular formula C11H11FN4O2S and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
PubChem CID62143731
Molecular FormulaC11H11FN4O2S
Molecular Weight282.30 g/mol
Exact Mass282.06
IUPAC Name2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
SMILESCc1ccc(F)c(NS(=O)(=O)c2cnc(N)nc2)c1
InChIInChI=1S/C11H11FN4O2S/c1-7-2-3-9(12)10(4-7)16-19(17,18)8-5-14-11(13)15-6-8/h2-6,16H,1H3,(H2,13,14,15)
InChIKeyVARQHJMUPNORPO-UHFFFAOYSA-N
XLogP1.31
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluoro-5-methylphenyl)-2-hydrazinylpyrimidine-5-sulfonamide
CID 61327363
2-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide
CID 62143379
4-amino-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 28968050
3-amino-4-bromo-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 115328714
N-(2-fluoro-5-methylphenyl)methanesulfonamide
CID 3847750
N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62143380
4-ethyl-N-(2-fluoro-5-methylphenyl)benzenesulfonamide
CID 7516558
6-amino-N-(2-chloro-5-methylphenyl)pyridine-3-sulfonamide
CID 107624515
N-(2-chloro-5-methylphenyl)-2-hydrazinylpyrimidine-5-sulfonamide
CID 107626553
3-amino-N-(2,5-difluorophenyl)-5-methylbenzenesulfonamide
CID 43256407
N-(5-amino-2-fluorophenyl)-3-methylbenzenesulfonamide
CID 16773976
N-(5-bromo-2-fluorophenyl)-2-hydrazinylpyrimidine-5-sulfonamide
CID 61328919

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide?
The IUPAC name of 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide (CID 62143731) is 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide?
The canonical SMILES for 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide is Cc1ccc(F)c(NS(=O)(=O)c2cnc(N)nc2)c1.
What is the InChIKey of 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide?
The InChIKey is VARQHJMUPNORPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN4O2S/c1-7-2-3-9(12)10(4-7)16-19(17,18)8-5-14-11(13)15-6-8/h2-6,16H,1H3,(H2,13,14,15).
What are the key properties of 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide?
2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide has a molecular weight of 282.30 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-fluoro-5-methylphenyl)pyrimidine-5-sulfonamide is sourced from PubChem (CID 62143731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).