1,2,3,4-tetrahydronaphthalene-1-sulfonamide

C10H13NO2S — CID 21221891

IUPAC1,2,3,4-tetrahydronaphthalene-1-sulfonamide
SMILESNS(=O)(=O)C1CCCc2ccccc21
InChIInChI=1S/C10H13NO2S/c11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H2,11,12,13)
InChIKeySRYALXBZLHTHHG-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.35
Rot. Bonds1

About 1,2,3,4-tetrahydronaphthalene-1-sulfonamide

1,2,3,4-tetrahydronaphthalene-1-sulfonamide (PubChem CID 21221891) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is 1,2,3,4-tetrahydronaphthalene-1-sulfonamide.

Molecular Properties

Compound Name1,2,3,4-tetrahydronaphthalene-1-sulfonamide
PubChem CID21221891
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC Name1,2,3,4-tetrahydronaphthalene-1-sulfonamide
SMILESNS(=O)(=O)C1CCCc2ccccc21
InChIInChI=1S/C10H13NO2S/c11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H2,11,12,13)
InChIKeySRYALXBZLHTHHG-UHFFFAOYSA-N
XLogP1.35
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
The IUPAC name of 1,2,3,4-tetrahydronaphthalene-1-sulfonamide (CID 21221891) is 1,2,3,4-tetrahydronaphthalene-1-sulfonamide.
What is the SMILES notation for 1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
The canonical SMILES for 1,2,3,4-tetrahydronaphthalene-1-sulfonamide is NS(=O)(=O)C1CCCc2ccccc21.
What is the InChIKey of 1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
The InChIKey is SRYALXBZLHTHHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7H2,(H2,11,12,13).
What are the key properties of 1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
1,2,3,4-tetrahydronaphthalene-1-sulfonamide has a molecular weight of 211.29 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydronaphthalene-1-sulfonamide is sourced from PubChem (CID 21221891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).