4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide

C11H15N3O3S — CID 67530085

IUPAC4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide
SMILESCNC(=O)c1ccc(NC2CC2)c(S(N)(=O)=O)c1
InChIInChI=1S/C11H15N3O3S/c1-13-11(15)7-2-5-9(14-8-3-4-8)10(6-7)18(12,16)17/h2,5-6,8,14H,3-4H2,1H3,(H,13,15)(H2,12,16,17)
InChIKeyGGMLDJUNLLZWQB-UHFFFAOYSA-N
MW269.33 g/mol
LogP0.27
Rot. Bonds4

About 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide

4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide (PubChem CID 67530085) has the molecular formula C11H15N3O3S and a molecular weight of 269.33 g/mol. Its IUPAC name is 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide.

Molecular Properties

Compound Name4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide
PubChem CID67530085
Molecular FormulaC11H15N3O3S
Molecular Weight269.33 g/mol
Exact Mass269.08
IUPAC Name4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide
SMILESCNC(=O)c1ccc(NC2CC2)c(S(N)(=O)=O)c1
InChIInChI=1S/C11H15N3O3S/c1-13-11(15)7-2-5-9(14-8-3-4-8)10(6-7)18(12,16)17/h2,5-6,8,14H,3-4H2,1H3,(H,13,15)(H2,12,16,17)
InChIKeyGGMLDJUNLLZWQB-UHFFFAOYSA-N
XLogP0.27
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.33
LogP ≤ 50.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-methyl-3-sulfamoylbenzamide
CID 60637185
3-[(4-aminocyclohexyl)amino]-N,4-dimethylbenzamide
CID 79730916
4-(cyclobutylamino)-3-fluoro-N-methylbenzamide
CID 174641609
4-amino-3-[(4-ethylcyclohexyl)amino]-N-methylbenzamide
CID 63357473
3-(cycloheptylamino)-N,4-dimethylbenzamide
CID 43726864
5-amino-2-(cyclopropylamino)-N-methylbenzamide
CID 100639685
4-amino-N-methyl-3-[(1-methylpiperidin-4-yl)amino]benzamide
CID 63357031
3-amino-4-[(1,2-dimethylpiperidin-4-yl)amino]-N-methylbenzamide
CID 83000233
4-(cycloheptylamino)-N-methyl-3-nitrobenzamide
CID 78969732
4-chloro-N-methyl-3-(thian-4-ylamino)benzamide
CID 43721059
N,3-dimethyl-4-(sulfamoylamino)benzamide
CID 112573608
4-(cyclopropylamino)-3-(2-methylpropylsulfamoyl)benzoic acid
CID 99977705

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide?
The IUPAC name of 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide (CID 67530085) is 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide.
What is the SMILES notation for 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide?
The canonical SMILES for 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide is CNC(=O)c1ccc(NC2CC2)c(S(N)(=O)=O)c1.
What is the InChIKey of 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide?
The InChIKey is GGMLDJUNLLZWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3S/c1-13-11(15)7-2-5-9(14-8-3-4-8)10(6-7)18(12,16)17/h2,5-6,8,14H,3-4H2,1H3,(H,13,15)(H2,12,16,17).
What are the key properties of 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide?
4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide has a molecular weight of 269.33 g/mol, XLogP of 0.27, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropylamino)-N-methyl-3-sulfamoylbenzamide is sourced from PubChem (CID 67530085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).