N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide

C11H15FN2O2S — CID 103300114

IUPACN-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide
SMILESCC(CC1CC1)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C11H15FN2O2S/c1-8(7-9-4-5-9)14-17(15,16)11-10(12)3-2-6-13-11/h2-3,6,8-9,14H,4-5,7H2,1H3
InChIKeyLZQZVCXGKAFXFR-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.69
Rot. Bonds5

About N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide

N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103300114) has the molecular formula C11H15FN2O2S and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide
PubChem CID103300114
Molecular FormulaC11H15FN2O2S
Molecular Weight258.32 g/mol
Exact Mass258.08
IUPAC NameN-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide
SMILESCC(CC1CC1)NS(=O)(=O)c1ncccc1F
InChIInChI=1S/C11H15FN2O2S/c1-8(7-9-4-5-9)14-17(15,16)11-10(12)3-2-6-13-11/h2-3,6,8-9,14H,4-5,7H2,1H3
InChIKeyLZQZVCXGKAFXFR-UHFFFAOYSA-N
XLogP1.69
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(Trifluoromethyl)pyridine-2-sulfonamide
CID 13910921
4-fluoro-N-(2-pyridin-4-ylethyl)benzenesulfonamide
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Gtps (ssre-018)
CID 146030227
4-fluoro-N'-[(1Z)-1-(pyridin-4-yl)ethylidene]benzenesulfonohydrazide
CID 25237590
4-fluoro-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 674996
3,4-difluoro-N-(2-pyridin-2-ylethyl)benzenesulfonamide
CID 2432838
3,4-difluoro-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 2473445
trans-N-(4-((R)-1-amino-2-(2,5-difluorophenyl)ethyl)cyclohexyl)-N-methylpyridine-3-sulfonamide
CID 53318856
4-Fluoro-3-methyl-N-pyridin-3-ylmethyl-benzenesulfonamide
CID 849940
N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 668758
5-Methyl-2-pyridinesulfonamide
CID 3614199

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide (CID 103300114) is N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide is CC(CC1CC1)NS(=O)(=O)c1ncccc1F.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is LZQZVCXGKAFXFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2O2S/c1-8(7-9-4-5-9)14-17(15,16)11-10(12)3-2-6-13-11/h2-3,6,8-9,14H,4-5,7H2,1H3.
What are the key properties of N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide?
N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 258.32 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103300114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).