6-propan-2-ylnaphthalene-2-sulfonamide

C13H15NO2S — CID 142387587

IUPAC6-propan-2-ylnaphthalene-2-sulfonamide
SMILESCC(C)c1ccc2cc(S(N)(=O)=O)ccc2c1
InChIInChI=1S/C13H15NO2S/c1-9(2)10-3-4-12-8-13(17(14,15)16)6-5-11(12)7-10/h3-9H,1-2H3,(H2,14,15,16)
InChIKeyOOWCJPUBDPALFH-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.61
Rot. Bonds2

About 6-propan-2-ylnaphthalene-2-sulfonamide

6-propan-2-ylnaphthalene-2-sulfonamide (PubChem CID 142387587) has the molecular formula C13H15NO2S and a molecular weight of 249.34 g/mol. Its IUPAC name is 6-propan-2-ylnaphthalene-2-sulfonamide.

Molecular Properties

Compound Name6-propan-2-ylnaphthalene-2-sulfonamide
PubChem CID142387587
Molecular FormulaC13H15NO2S
Molecular Weight249.34 g/mol
Exact Mass249.08
IUPAC Name6-propan-2-ylnaphthalene-2-sulfonamide
SMILESCC(C)c1ccc2cc(S(N)(=O)=O)ccc2c1
InChIInChI=1S/C13H15NO2S/c1-9(2)10-3-4-12-8-13(17(14,15)16)6-5-11(12)7-10/h3-9H,1-2H3,(H2,14,15,16)
InChIKeyOOWCJPUBDPALFH-UHFFFAOYSA-N
XLogP2.61
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

potassium 4-propan-2-ylbenzenesulfonamide
CID 19095755
2,6-di(propan-2-yl)naphthalene;ethane
CID 142320223
2,9-di(propan-2-yl)pentacene
CID 153380534
ethane;2-propan-2-ylnaphthalene
CID 142226111
2-propan-2-yl-6-(6-propan-2-ylnaphthalen-2-yl)naphthalene
CID 59610790
4-amino-3-(4-propan-2-ylanilino)benzenesulfonamide
CID 82900050
3-fluoro-4-[(4-propan-2-ylphenyl)sulfonylamino]benzenesulfonamide
CID 60579391
2-propan-2-ylpentacene
CID 153380535
N-(4-propan-2-ylphenyl)naphthalene-2-sulfonamide
CID 3997695
3-hydroxynaphthalene-2,7-disulfonamide
CID 70464253
7-acetyl-6-hydroxynaphthalene-2-sulfonamide
CID 142667787
3-(6-methylsulfonylnaphthalen-2-yl)butan-2-one
CID 159692775

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-ylnaphthalene-2-sulfonamide?
The IUPAC name of 6-propan-2-ylnaphthalene-2-sulfonamide (CID 142387587) is 6-propan-2-ylnaphthalene-2-sulfonamide.
What is the SMILES notation for 6-propan-2-ylnaphthalene-2-sulfonamide?
The canonical SMILES for 6-propan-2-ylnaphthalene-2-sulfonamide is CC(C)c1ccc2cc(S(N)(=O)=O)ccc2c1.
What is the InChIKey of 6-propan-2-ylnaphthalene-2-sulfonamide?
The InChIKey is OOWCJPUBDPALFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2S/c1-9(2)10-3-4-12-8-13(17(14,15)16)6-5-11(12)7-10/h3-9H,1-2H3,(H2,14,15,16).
What are the key properties of 6-propan-2-ylnaphthalene-2-sulfonamide?
6-propan-2-ylnaphthalene-2-sulfonamide has a molecular weight of 249.34 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-ylnaphthalene-2-sulfonamide is sourced from PubChem (CID 142387587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).