2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide

C16H17N3O4S — CID 130406117

IUPAC2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide
SMILESNC(=O)c1cc(S(=O)(=O)Nc2ccc3c(c2)NCCC3)ccc1O
InChIInChI=1S/C16H17N3O4S/c17-16(21)13-9-12(5-6-15(13)20)24(22,23)19-11-4-3-10-2-1-7-18-14(10)8-11/h3-6,8-9,18-20H,1-2,7H2,(H2,17,21)
InChIKeyRJHRJEQGAXBHLA-UHFFFAOYSA-N
MW347.40 g/mol
LogP1.65
Rot. Bonds4

About 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide

2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide (PubChem CID 130406117) has the molecular formula C16H17N3O4S and a molecular weight of 347.40 g/mol. Its IUPAC name is 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide.

Molecular Properties

Compound Name2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide
PubChem CID130406117
Molecular FormulaC16H17N3O4S
Molecular Weight347.40 g/mol
Exact Mass347.09
IUPAC Name2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide
SMILESNC(=O)c1cc(S(=O)(=O)Nc2ccc3c(c2)NCCC3)ccc1O
InChIInChI=1S/C16H17N3O4S/c17-16(21)13-9-12(5-6-15(13)20)24(22,23)19-11-4-3-10-2-1-7-18-14(10)8-11/h3-6,8-9,18-20H,1-2,7H2,(H2,17,21)
InChIKeyRJHRJEQGAXBHLA-UHFFFAOYSA-N
XLogP1.65
TPSA121.52 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 51.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

5-[[4-(benzenesulfonamido)phenyl]sulfamoyl]-2-hydroxybenzamide
CID 130406207
2-hydroxy-5-[[3-(methanesulfonamido)phenyl]sulfamoyl]benzamide
CID 130406205
2-hydroxy-5-[(3-hydroxyphenyl)sulfamoyl]benzamide
CID 130406151
5-[[3-(benzenesulfonamido)phenyl]sulfamoyl]-2-hydroxybenzamide
CID 130406327
N-(1,2,3,4-tetrahydroquinolin-7-yl)-1H-pyrazole-5-sulfonamide
CID 102693598
2-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)propanoic acid
CID 63931455
2-chloro-N-(1,2,3,4-tetrahydroquinolin-7-yl)benzenesulfonamide
CID 63928946
5-[[4-[(3-carboxy-4-hydroxyphenyl)sulfonylamino]phenyl]sulfamoyl]-2-hydroxybenzoic acid
CID 25046771
N-[4-(2-chloroacetyl)phenyl]-2,3-dihydro-1H-indole-6-sulfonamide
CID 90701518
methyl 3-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)propanoate
CID 63931457
1,2,3,4-tetrahydroquinoline-7-sulfonic acid;hydrate
CID 71328506
2-methylsulfonyl-N-(1,2,3,4-tetrahydroquinolin-7-yl)ethanesulfonamide
CID 63928943

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide?
The IUPAC name of 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide (CID 130406117) is 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide.
What is the SMILES notation for 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide?
The canonical SMILES for 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide is NC(=O)c1cc(S(=O)(=O)Nc2ccc3c(c2)NCCC3)ccc1O.
What is the InChIKey of 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide?
The InChIKey is RJHRJEQGAXBHLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4S/c17-16(21)13-9-12(5-6-15(13)20)24(22,23)19-11-4-3-10-2-1-7-18-14(10)8-11/h3-6,8-9,18-20H,1-2,7H2,(H2,17,21).
What are the key properties of 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide?
2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide has a molecular weight of 347.40 g/mol, XLogP of 1.65, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-5-(1,2,3,4-tetrahydroquinolin-7-ylsulfamoyl)benzamide is sourced from PubChem (CID 130406117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).