N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride

C10H15ClF2N2O2S — CID 119987957

IUPACN-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride
SMILESCC(C)(N)CNS(=O)(=O)c1c(F)cccc1F.Cl
InChIInChI=1S/C10H14F2N2O2S.ClH/c1-10(2,13)6-14-17(15,16)9-7(11)4-3-5-8(9)12;/h3-5,14H,6,13H2,1-2H3;1H
InChIKeySGGFUNZPDCMTQJ-UHFFFAOYSA-N
MW300.76 g/mol
LogP1.40
Rot. Bonds4

About N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride

N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride (PubChem CID 119987957) has the molecular formula C10H15ClF2N2O2S and a molecular weight of 300.76 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride
PubChem CID119987957
Molecular FormulaC10H15ClF2N2O2S
Molecular Weight300.76 g/mol
Exact Mass300.05
IUPAC NameN-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride
SMILESCC(C)(N)CNS(=O)(=O)c1c(F)cccc1F.Cl
InChIInChI=1S/C10H14F2N2O2S.ClH/c1-10(2,13)6-14-17(15,16)9-7(11)4-3-5-8(9)12;/h3-5,14H,6,13H2,1-2H3;1H
InChIKeySGGFUNZPDCMTQJ-UHFFFAOYSA-N
XLogP1.40
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.76
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-chlorophenyl)-2-methoxypropyl]-2,6-difluorobenzenesulfonamide
CID 90600032
2,6-difluoro-N-(2-hydroxy-3-methoxy-2-methylpropyl)benzenesulfonamide
CID 90501122
2-amino-6-fluoro-N-(2-methyl-2-methylsulfonylpropyl)benzenesulfonamide
CID 79551282
N-(2-aminoethyl)-2,6-difluorobenzenesulfonamide
CID 43603529
N-(2-amino-2-methylpropyl)-3-fluoropyridine-2-sulfonamide
CID 103302638
N-(2-amino-2-methylpropyl)-4-fluorobenzenesulfonamide;hydrochloride
CID 119988167
N-(2-amino-2-methylpropyl)benzenesulfonamide;hydrochloride
CID 90081725
N-(2-amino-2-methylpropyl)-3-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 119988015
N-(2-amino-2-methylpropyl)-4-chlorobenzenesulfonamide;hydrochloride
CID 119988011
2-[(2,6-difluorophenyl)sulfonylamino]ethyl-dimethylazanium
CID 8716783
N-(2-amino-2-methylpropyl)-2-methylsulfanylbenzenesulfonamide;hydrochloride
CID 120711544
N-(2-amino-2-methylpropyl)naphthalene-1-sulfonamide
CID 84591300

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride?
The IUPAC name of N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride (CID 119987957) is N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride?
The canonical SMILES for N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride is CC(C)(N)CNS(=O)(=O)c1c(F)cccc1F.Cl.
What is the InChIKey of N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride?
The InChIKey is SGGFUNZPDCMTQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2O2S.ClH/c1-10(2,13)6-14-17(15,16)9-7(11)4-3-5-8(9)12;/h3-5,14H,6,13H2,1-2H3;1H.
What are the key properties of N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride?
N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride has a molecular weight of 300.76 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-2,6-difluorobenzenesulfonamide;hydrochloride is sourced from PubChem (CID 119987957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).