3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide

C18H19N3O4S — CID 72906058

IUPAC3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide
SMILESO=C(CNS(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1)NC1CC1
InChIInChI=1S/C18H19N3O4S/c22-17(20-15-9-10-15)12-19-26(24,25)16-8-4-5-13(11-16)18(23)21-14-6-2-1-3-7-14/h1-8,11,15,19H,9-10,12H2,(H,20,22)(H,21,23)
InChIKeyAHIVMYUMNOVFET-UHFFFAOYSA-N
MW373.43 g/mol
LogP1.50
Rot. Bonds7

About 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide

3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide (PubChem CID 72906058) has the molecular formula C18H19N3O4S and a molecular weight of 373.43 g/mol. Its IUPAC name is 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound Name3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide
PubChem CID72906058
Molecular FormulaC18H19N3O4S
Molecular Weight373.43 g/mol
Exact Mass373.11
IUPAC Name3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide
SMILESO=C(CNS(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1)NC1CC1
InChIInChI=1S/C18H19N3O4S/c22-17(20-15-9-10-15)12-19-26(24,25)16-8-4-5-13(11-16)18(23)21-14-6-2-1-3-7-14/h1-8,11,15,19H,9-10,12H2,(H,20,22)(H,21,23)
InChIKeyAHIVMYUMNOVFET-UHFFFAOYSA-N
XLogP1.50
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.43
LogP ≤ 51.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-anilinophenyl)-3-(cyclopropylmethylsulfamoyl)benzamide
CID 37005243
3-(benzylsulfamoyl)-N-cyclopropylbenzamide
CID 9165600
N-phenyl-3-(prop-2-ynylsulfamoyl)benzamide
CID 46664277
2-[[3-(aminomethyl)phenyl]sulfonylamino]-N-cyclopropylacetamide
CID 43568463
3-(2-methoxyethylsulfamoyl)-N-phenylbenzamide
CID 6463975
3-(cyclopropylsulfamoyl)-N-(4-phenoxyphenyl)benzamide
CID 30858539
N-cyclopentyl-2-[(3-fluorophenyl)sulfonylamino]acetamide
CID 154858378
N-[4-(carbamoylamino)phenyl]-3-(cyclopropylmethylsulfamoyl)benzamide
CID 37027882
3-(benzenesulfonamido)-N-cyclopropylbenzamide
CID 17465618
3-(cyclopropylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 27700197
N-cycloheptyl-2-[(3-methylphenyl)sulfonylamino]acetamide
CID 112995022
3-(cyclopropylmethylsulfamoyl)-N-pyridin-4-ylbenzamide
CID 37004365

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide?
The IUPAC name of 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide (CID 72906058) is 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide?
The canonical SMILES for 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide is O=C(CNS(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1)NC1CC1.
What is the InChIKey of 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide?
The InChIKey is AHIVMYUMNOVFET-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O4S/c22-17(20-15-9-10-15)12-19-26(24,25)16-8-4-5-13(11-16)18(23)21-14-6-2-1-3-7-14/h1-8,11,15,19H,9-10,12H2,(H,20,22)(H,21,23).
What are the key properties of 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide?
3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide has a molecular weight of 373.43 g/mol, XLogP of 1.50, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(cyclopropylamino)-2-oxoethyl]sulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 72906058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).