N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide

C17H15N3O5S — CID 46680383

IUPACN-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide
SMILESO=C(NC1CC1)c1cccc(NS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c1
InChIInChI=1S/C17H15N3O5S/c21-16(18-11-4-5-11)10-2-1-3-12(8-10)20-26(23,24)13-6-7-14-15(9-13)25-17(22)19-14/h1-3,6-9,11,20H,4-5H2,(H,18,21)(H,19,22)
InChIKeyZNBCUGRPQVSLNI-UHFFFAOYSA-N
MW373.39 g/mol
LogP1.81
Rot. Bonds5

About N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide

N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide (PubChem CID 46680383) has the molecular formula C17H15N3O5S and a molecular weight of 373.39 g/mol. Its IUPAC name is N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide
PubChem CID46680383
Molecular FormulaC17H15N3O5S
Molecular Weight373.39 g/mol
Exact Mass373.07
IUPAC NameN-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide
SMILESO=C(NC1CC1)c1cccc(NS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c1
InChIInChI=1S/C17H15N3O5S/c21-16(18-11-4-5-11)10-2-1-3-12(8-10)20-26(23,24)13-6-7-14-15(9-13)25-17(22)19-14/h1-3,6-9,11,20H,4-5H2,(H,18,21)(H,19,22)
InChIKeyZNBCUGRPQVSLNI-UHFFFAOYSA-N
XLogP1.81
TPSA121.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.39
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3-(benzenesulfonamido)-N-cyclopropylbenzamide
CID 17465618
N-cyclopropyl-3-[(4-cyclopropylphenyl)sulfonylamino]benzamide
CID 167833629
N-(3-cyclopentyloxyphenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 35547980
N-(3-fluorophenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 24686498
N-methyl-4-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide
CID 134055659
3-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-cyclopropylbenzamide
CID 22109314
2-oxo-N-(oxolan-3-yl)-3H-1,3-benzoxazole-6-sulfonamide
CID 110868860
N-cyclopropyl-3-[(3-methoxyphenyl)sulfamoyl]benzamide
CID 109062340
cis-(1S,3R)-3-[[3-(benzenesulfonamido)benzoyl]amino]cyclopentane-1-carboxylic acid
CID 120674975
3-[(3-chlorophenyl)sulfamoyl]-N-cyclohexylbenzamide
CID 9043246
N-(4-aminocyclohexyl)-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 119474947
N-(4-aminophenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide
CID 82104270

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide?
The IUPAC name of N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide (CID 46680383) is N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide.
What is the SMILES notation for N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide?
The canonical SMILES for N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide is O=C(NC1CC1)c1cccc(NS(=O)(=O)c2ccc3[nH]c(=O)oc3c2)c1.
What is the InChIKey of N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide?
The InChIKey is ZNBCUGRPQVSLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O5S/c21-16(18-11-4-5-11)10-2-1-3-12(8-10)20-26(23,24)13-6-7-14-15(9-13)25-17(22)19-14/h1-3,6-9,11,20H,4-5H2,(H,18,21)(H,19,22).
What are the key properties of N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide?
N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide has a molecular weight of 373.39 g/mol, XLogP of 1.81, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]benzamide is sourced from PubChem (CID 46680383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).