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

C11H15NO3S — CID 115000583

IUPAC6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide
SMILESCOc1ccc2c(c1)CCCC2S(N)(=O)=O
InChIInChI=1S/C11H15NO3S/c1-15-9-5-6-10-8(7-9)3-2-4-11(10)16(12,13)14/h5-7,11H,2-4H2,1H3,(H2,12,13,14)
InChIKeyCVSGQDDZKVXYJI-UHFFFAOYSA-N
MW241.31 g/mol
LogP1.36
Rot. Bonds2

About 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide

6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide (PubChem CID 115000583) has the molecular formula C11H15NO3S and a molecular weight of 241.31 g/mol. Its IUPAC name is 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide.

Molecular Properties

Compound Name6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide
PubChem CID115000583
Molecular FormulaC11H15NO3S
Molecular Weight241.31 g/mol
Exact Mass241.08
IUPAC Name6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide
SMILESCOc1ccc2c(c1)CCCC2S(N)(=O)=O
InChIInChI=1S/C11H15NO3S/c1-15-9-5-6-10-8(7-9)3-2-4-11(10)16(12,13)14/h5-7,11H,2-4H2,1H3,(H2,12,13,14)
InChIKeyCVSGQDDZKVXYJI-UHFFFAOYSA-N
XLogP1.36
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
CID 78319340
(2R)-2-amino-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 119289450
N'-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzenesulfonohydrazide
CID 124639032
6-methoxy-N-(2-methoxy-2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115728733
2-amino-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-(oxan-4-yl)acetamide
CID 120787446
6-methoxy-2-(oxan-4-ylsulfinyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 64654435
methyl 2-hydroxy-2-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-3-methylbutanoate
CID 79304285
ethane;methanamine;6-(3-methoxyphenyl)sulfonyl-1-methyl-1,2,3,4-tetrahydronaphthalene
CID 143248357
2,2,2-trichloroethyl N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)sulfamate
CID 24761683
N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,2-dimethylpropanamide
CID 98004897
(1S)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 71756873
(1R)-1-(3-bromopropyl)-6-methoxy-1,2,3,4-tetrahydronaphthalene
CID 129410305

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
The IUPAC name of 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide (CID 115000583) is 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide.
What is the SMILES notation for 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
The canonical SMILES for 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide is COc1ccc2c(c1)CCCC2S(N)(=O)=O.
What is the InChIKey of 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
The InChIKey is CVSGQDDZKVXYJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3S/c1-15-9-5-6-10-8(7-9)3-2-4-11(10)16(12,13)14/h5-7,11H,2-4H2,1H3,(H2,12,13,14).
What are the key properties of 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide?
6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide has a molecular weight of 241.31 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1,2,3,4-tetrahydronaphthalene-1-sulfonamide is sourced from PubChem (CID 115000583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).