N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide

C19H24N2O3S — CID 68955632

IUPACN-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccccc2)c2c1C[C@@H](N(C)C)CC2
InChIInChI=1S/C19H24N2O3S/c1-21(2)14-9-10-16-17(13-14)19(24-3)12-11-18(16)20-25(22,23)15-7-5-4-6-8-15/h4-8,11-12,14,20H,9-10,13H2,1-3H3/t14-/m0/s1
InChIKeyYZMLQJNXARVAMO-AWEZNQCLSA-N
MW360.48 g/mol
LogP2.91
Rot. Bonds5

About N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide

N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide (PubChem CID 68955632) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide.

Molecular Properties

Compound NameN-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide
PubChem CID68955632
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide
SMILESCOc1ccc(NS(=O)(=O)c2ccccc2)c2c1C[C@@H](N(C)C)CC2
InChIInChI=1S/C19H24N2O3S/c1-21(2)14-9-10-16-17(13-14)19(24-3)12-11-18(16)20-25(22,23)15-7-5-4-6-8-15/h4-8,11-12,14,20H,9-10,13H2,1-3H3/t14-/m0/s1
InChIKeyYZMLQJNXARVAMO-AWEZNQCLSA-N
XLogP2.91
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide with MolForge

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Related Compounds

N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]-3-fluoro-4-methoxybenzenesulfonamide
CID 68956567
3,4-dichloro-N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide
CID 15950213
N-[6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]-6-phenoxypyridine-3-sulfonamide
CID 73204198
(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide
CID 11999840
N-[6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]-2,5-difluorobenzenesulfonamide
CID 73204327
N-[(6S)-6-(dimethylamino)-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide
CID 24777062
4-tert-butyl-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzenesulfonamide
CID 15949035
N-[4-(dimethylsulfamoylamino)-2-methoxyphenyl]benzenesulfonamide
CID 21239388
2-cyano-N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]benzenesulfonamide
CID 68952502
3,5-dichloro-N-(4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 143337884
N-[(3R)-3-(dimethylamino)-5-methoxy-3,4-dihydro-2H-chromen-8-yl]-4-methylnaphthalene-1-sulfonamide
CID 15949694
[4-(benzenesulfonamido)-3-methoxyphenyl] thiocyanate
CID 17324398

Frequently Asked Questions

What is the IUPAC name of N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide?
The IUPAC name of N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide (CID 68955632) is N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide.
What is the SMILES notation for N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide?
The canonical SMILES for N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide is COc1ccc(NS(=O)(=O)c2ccccc2)c2c1C[C@@H](N(C)C)CC2.
What is the InChIKey of N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide?
The InChIKey is YZMLQJNXARVAMO-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-21(2)14-9-10-16-17(13-14)19(24-3)12-11-18(16)20-25(22,23)15-7-5-4-6-8-15/h4-8,11-12,14,20H,9-10,13H2,1-3H3/t14-/m0/s1.
What are the key properties of N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide?
N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide has a molecular weight of 360.48 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6S)-6-(dimethylamino)-4-methoxy-5,6,7,8-tetrahydronaphthalen-1-yl]benzenesulfonamide is sourced from PubChem (CID 68955632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).