2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide

C19H17NO4S — CID 55544360

IUPAC2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide
SMILESO=c1ccc2cc(S(=O)(=O)Nc3cccc4c3CCCC4)ccc2o1
InChIInChI=1S/C19H17NO4S/c21-19-11-8-14-12-15(9-10-18(14)24-19)25(22,23)20-17-7-3-5-13-4-1-2-6-16(13)17/h3,5,7-12,20H,1-2,4,6H2
InChIKeyNZXUMQOXFRQJSB-UHFFFAOYSA-N
MW355.42 g/mol
LogP3.47
Rot. Bonds3

About 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide

2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide (PubChem CID 55544360) has the molecular formula C19H17NO4S and a molecular weight of 355.42 g/mol. Its IUPAC name is 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide.

Molecular Properties

Compound Name2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide
PubChem CID55544360
Molecular FormulaC19H17NO4S
Molecular Weight355.42 g/mol
Exact Mass355.09
IUPAC Name2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide
SMILESO=c1ccc2cc(S(=O)(=O)Nc3cccc4c3CCCC4)ccc2o1
InChIInChI=1S/C19H17NO4S/c21-19-11-8-14-12-15(9-10-18(14)24-19)25(22,23)20-17-7-3-5-13-4-1-2-6-16(13)17/h3,5,7-12,20H,1-2,4,6H2
InChIKeyNZXUMQOXFRQJSB-UHFFFAOYSA-N
XLogP3.47
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

3-methyl-2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-1,3-benzoxazole-6-sulfonamide
CID 666515
3,4-difluoro-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 3832524
N-(3-chloro-2-morpholin-4-ylphenyl)-2-oxochromene-6-sulfonamide
CID 30782532
3-fluoro-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 3391096
3-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 5104116
N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-oxochromene-6-sulfonamide
CID 30784509
N-methyl-2-oxochromene-6-sulfonamide
CID 43245047
3-cyano-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 26970591
N-(5,6,7,8-tetrahydronaphthalen-1-yl)-6,7,8,9-tetrahydro-5H-carbazole-3-sulfonamide
CID 20909788
1-N-cyclopropyl-4-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzene-1,4-disulfonamide
CID 35507830
N-methyl-3-[(2-oxochromen-6-yl)sulfonylamino]benzamide
CID 134040442
2-[(2-oxochromen-6-yl)sulfonylamino]-N-propylbenzamide
CID 30713734

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide?
The IUPAC name of 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide (CID 55544360) is 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide.
What is the SMILES notation for 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide?
The canonical SMILES for 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide is O=c1ccc2cc(S(=O)(=O)Nc3cccc4c3CCCC4)ccc2o1.
What is the InChIKey of 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide?
The InChIKey is NZXUMQOXFRQJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO4S/c21-19-11-8-14-12-15(9-10-18(14)24-19)25(22,23)20-17-7-3-5-13-4-1-2-6-16(13)17/h3,5,7-12,20H,1-2,4,6H2.
What are the key properties of 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide?
2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide has a molecular weight of 355.42 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-(5,6,7,8-tetrahydronaphthalen-1-yl)chromene-6-sulfonamide is sourced from PubChem (CID 55544360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).