(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide

C19H24N2O3S — CID 11999840

IUPAC(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2)c2c1C[C@H](N(C)C)CC2
InChIInChI=1S/C19H24N2O3S/c1-21(2)15-9-10-16-17(13-15)18(24-3)11-12-19(16)25(22,23)20-14-7-5-4-6-8-14/h4-8,11-12,15,20H,9-10,13H2,1-3H3/t15-/m1/s1
InChIKeyRQTGUEBAPZYYAQ-OAHLLOKOSA-N
MW360.48 g/mol
LogP2.91
Rot. Bonds5

About (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide

(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide (PubChem CID 11999840) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide.

Molecular Properties

Compound Name(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide
PubChem CID11999840
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2)c2c1C[C@H](N(C)C)CC2
InChIInChI=1S/C19H24N2O3S/c1-21(2)15-9-10-16-17(13-15)18(24-3)11-12-19(16)25(22,23)20-14-7-5-4-6-8-14/h4-8,11-12,15,20H,9-10,13H2,1-3H3/t15-/m1/s1
InChIKeyRQTGUEBAPZYYAQ-OAHLLOKOSA-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

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide?
The IUPAC name of (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide (CID 11999840) is (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide.
What is the SMILES notation for (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide?
The canonical SMILES for (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide is COc1ccc(S(=O)(=O)Nc2ccccc2)c2c1C[C@H](N(C)C)CC2.
What is the InChIKey of (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide?
The InChIKey is RQTGUEBAPZYYAQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-21(2)15-9-10-16-17(13-15)18(24-3)11-12-19(16)25(22,23)20-14-7-5-4-6-8-14/h4-8,11-12,15,20H,9-10,13H2,1-3H3/t15-/m1/s1.
What are the key properties of (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide?
(6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide 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 (6R)-6-(dimethylamino)-4-methoxy-N-phenyl-5,6,7,8-tetrahydronaphthalene-1-sulfonamide is sourced from PubChem (CID 11999840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).