2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide

C10H10F3NO3S — CID 155434237

IUPAC2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide
SMILESNS(=O)(=O)c1cccc2c1OC(C(F)(F)F)CC2
InChIInChI=1S/C10H10F3NO3S/c11-10(12,13)8-5-4-6-2-1-3-7(9(6)17-8)18(14,15)16/h1-3,8H,4-5H2,(H2,14,15,16)
InChIKeyUJIKFERNQZBHIU-UHFFFAOYSA-N
MW281.25 g/mol
LogP1.59
Rot. Bonds1

About 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide

2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide (PubChem CID 155434237) has the molecular formula C10H10F3NO3S and a molecular weight of 281.25 g/mol. Its IUPAC name is 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide.

Molecular Properties

Compound Name2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide
PubChem CID155434237
Molecular FormulaC10H10F3NO3S
Molecular Weight281.25 g/mol
Exact Mass281.03
IUPAC Name2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide
SMILESNS(=O)(=O)c1cccc2c1OC(C(F)(F)F)CC2
InChIInChI=1S/C10H10F3NO3S/c11-10(12,13)8-5-4-6-2-1-3-7(9(6)17-8)18(14,15)16/h1-3,8H,4-5H2,(H2,14,15,16)
InChIKeyUJIKFERNQZBHIU-UHFFFAOYSA-N
XLogP1.59
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-Fluoro-2-methyl-2-(4-methylpentyl)-3,4-dihydrochromene-6-sulfonamide
CID 89943925
6-Ethyl-3-trifluoromethyl-2,3-dihydro-benzo[1,4]oxathiine 4,4-dioxide
CID 571273
2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-sulfonamide
CID 13424180
3,4-Dihydro-2H-1-benzopyran-6-sulfonyl chloride
CID 24267858
3,4-Dihydro-2H-1-benzopyran-8-sulfonyl chloride
CID 45594303
3,4-dihydro-2H-1-benzopyran-6-sulfonamide
CID 63840602
2,2-Dimethyl-3,4-dihydro-2H-1-benzopyran-8-sulfonamide
CID 71326365
2-Methyl-2,3-dihydro-1-benzofuran-7-sulfonyl chloride
CID 83895355
3,4-dihydro-2H-1-benzopyran-4-sulfonamide
CID 114999292
2,2-Dimethyl-3,4-dihydrochromene-8-sulfonyl chloride
CID 84710266
2-(difluoromethyl)-3,4-dihydro-2H-1-benzopyran-6-sulfonyl chloride
CID 165664763
Propyl-2-methoxybenzenesulfonamide
CID 23023000

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide?
The IUPAC name of 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide (CID 155434237) is 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide.
What is the SMILES notation for 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide?
The canonical SMILES for 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide is NS(=O)(=O)c1cccc2c1OC(C(F)(F)F)CC2.
What is the InChIKey of 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide?
The InChIKey is UJIKFERNQZBHIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO3S/c11-10(12,13)8-5-4-6-2-1-3-7(9(6)17-8)18(14,15)16/h1-3,8H,4-5H2,(H2,14,15,16).
What are the key properties of 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide?
2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide has a molecular weight of 281.25 g/mol, XLogP of 1.59, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-3,4-dihydro-2H-chromene-8-sulfonamide is sourced from PubChem (CID 155434237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).