N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide

C14H16N2O2S — CID 110865788

IUPACN-(2-propan-2-ylphenyl)pyridine-3-sulfonamide
SMILESCC(C)c1ccccc1NS(=O)(=O)c1cccnc1
InChIInChI=1S/C14H16N2O2S/c1-11(2)13-7-3-4-8-14(13)16-19(17,18)12-6-5-9-15-10-12/h3-11,16H,1-2H3
InChIKeyKFYHVTNRWMBIQK-UHFFFAOYSA-N
MW276.36 g/mol
LogP3.01
Rot. Bonds4

About N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide

N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide (PubChem CID 110865788) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-propan-2-ylphenyl)pyridine-3-sulfonamide
PubChem CID110865788
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-(2-propan-2-ylphenyl)pyridine-3-sulfonamide
SMILESCC(C)c1ccccc1NS(=O)(=O)c1cccnc1
InChIInChI=1S/C14H16N2O2S/c1-11(2)13-7-3-4-8-14(13)16-19(17,18)12-6-5-9-15-10-12/h3-11,16H,1-2H3
InChIKeyKFYHVTNRWMBIQK-UHFFFAOYSA-N
XLogP3.01
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide
CID 62149213
N-(4-propan-2-ylphenyl)pyridine-3-sulfonamide
CID 110865791
N-(2-bromo-3-pyridinyl)pyridine-3-sulfonamide
CID 103816034
4-(methylamino)-N-(2-propan-2-ylphenyl)benzenesulfonamide
CID 43332053
4-(aminomethyl)-N-(2-propan-2-ylphenyl)benzenesulfonamide
CID 29045454
N-[2-(1-hydroxyethyl)phenyl]benzenesulfonamide
CID 43416706
N-[2-(3-hydroxyprop-1-ynyl)phenyl]pyridine-3-sulfonamide
CID 60814918
N-(4-iodo-2-methylphenyl)pyridine-3-sulfonamide
CID 3865818
N-(4-amino-2-methylphenyl)pyridine-3-sulfonamide
CID 24696951
(2S)-2-[2-(benzenesulfonamido)phenyl]propanoic acid
CID 141071550
N-(2,5-dichlorophenyl)pyridine-3-sulfonamide
CID 16638548
3-amino-4-hydroxy-N-(2-propan-2-ylphenyl)benzenesulfonamide
CID 29035063

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide?
The IUPAC name of N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide (CID 110865788) is N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide is CC(C)c1ccccc1NS(=O)(=O)c1cccnc1.
What is the InChIKey of N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide?
The InChIKey is KFYHVTNRWMBIQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-11(2)13-7-3-4-8-14(13)16-19(17,18)12-6-5-9-15-10-12/h3-11,16H,1-2H3.
What are the key properties of N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide?
N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide has a molecular weight of 276.36 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 110865788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).