4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide

C20H25NO4S — CID 100753581

IUPAC4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide
SMILESCOc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1ccc(OC)c(C)c1C
InChIInChI=1S/C20H25NO4S/c1-13-14(2)20(11-10-19(13)25-4)26(22,23)21-18-7-5-6-15-12-16(24-3)8-9-17(15)18/h8-12,18,21H,5-7H2,1-4H3/t18-/m1/s1
InChIKeyNQWOVDMJCHJZAH-GOSISDBHSA-N
MW375.49 g/mol
LogP3.68
Rot. Bonds5

About 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide

4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide (PubChem CID 100753581) has the molecular formula C20H25NO4S and a molecular weight of 375.49 g/mol. Its IUPAC name is 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide
PubChem CID100753581
Molecular FormulaC20H25NO4S
Molecular Weight375.49 g/mol
Exact Mass375.15
IUPAC Name4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide
SMILESCOc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1ccc(OC)c(C)c1C
InChIInChI=1S/C20H25NO4S/c1-13-14(2)20(11-10-19(13)25-4)26(22,23)21-18-7-5-6-15-12-16(24-3)8-9-17(15)18/h8-12,18,21H,5-7H2,1-4H3/t18-/m1/s1
InChIKeyNQWOVDMJCHJZAH-GOSISDBHSA-N
XLogP3.68
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.49
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide with MolForge

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Related Compounds

N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
CID 78319340
N-cyclohexyl-4-methoxy-2,3-dimethylbenzenesulfonamide
CID 2234313
2,2,2-trichloroethyl N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)sulfamate
CID 24761683
2,5-dimethoxy-N-[(4R)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]benzenesulfonamide
CID 94113755
N-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-4-cyano-2-methoxybenzenesulfonamide;hydrochloride
CID 120876321
N'-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzenesulfonohydrazide
CID 124639032
N-(dicyclopropylmethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43096402
N-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)-2-methoxy-5-nitrobenzenesulfonamide;hydrochloride
CID 120722399
N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,2-dimethylpropanamide
CID 98004897
4-methoxy-N-(5-methyl-2,3-dihydro-1H-inden-1-yl)benzenesulfonamide
CID 154859038
N-[5-[(3,4-dimethoxyphenyl)sulfonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]acetamide
CID 54530988
6-methoxy-N-(2-methoxy-2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115728733

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide?
The IUPAC name of 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide (CID 100753581) is 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide?
The canonical SMILES for 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide is COc1ccc2c(c1)CCC[C@H]2NS(=O)(=O)c1ccc(OC)c(C)c1C.
What is the InChIKey of 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide?
The InChIKey is NQWOVDMJCHJZAH-GOSISDBHSA-N. The full InChI is InChI=1S/C20H25NO4S/c1-13-14(2)20(11-10-19(13)25-4)26(22,23)21-18-7-5-6-15-12-16(24-3)8-9-17(15)18/h8-12,18,21H,5-7H2,1-4H3/t18-/m1/s1.
What are the key properties of 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide?
4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide has a molecular weight of 375.49 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide is sourced from PubChem (CID 100753581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).