N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride

C11H18ClN3O3S — CID 119689582

IUPACN-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C.Cl
InChIInChI=1S/C11H17N3O3S.ClH/c1-7-4-9(18(12,16)17)5-10(8(7)2)14-11(15)6-13-3;/h4-5,13H,6H2,1-3H3,(H,14,15)(H2,12,16,17);1H
InChIKeyXNUQPECFMBBRMW-UHFFFAOYSA-N
MW307.80 g/mol
LogP0.53
Rot. Bonds4

About N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride

N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride (PubChem CID 119689582) has the molecular formula C11H18ClN3O3S and a molecular weight of 307.80 g/mol. Its IUPAC name is N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride
PubChem CID119689582
Molecular FormulaC11H18ClN3O3S
Molecular Weight307.80 g/mol
Exact Mass307.08
IUPAC NameN-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride
SMILESCNCC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C.Cl
InChIInChI=1S/C11H17N3O3S.ClH/c1-7-4-9(18(12,16)17)5-10(8(7)2)14-11(15)6-13-3;/h4-5,13H,6H2,1-3H3,(H,14,15)(H2,12,16,17);1H
InChIKeyXNUQPECFMBBRMW-UHFFFAOYSA-N
XLogP0.53
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.80
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(2,3-dimethyl-5-sulfamoylanilino)-2-oxoethyl]acetamide
CID 60848496
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(propan-2-ylamino)acetamide
CID 60671270
N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
CID 47109493
4-amino-N-(2,3-dimethyl-5-sulfamoylphenyl)butanamide
CID 43703344
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide
CID 55678440
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119689597
2-[2-(2,3-dimethyl-5-sulfamoylanilino)-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide
CID 9141642
2-[butyl(ethyl)amino]-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
CID 34603259
4-(3,4-dimethylphenyl)-N-(2,3-dimethyl-5-sulfamoylphenyl)-4-oxobutanamide
CID 9257617
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919356
3-chloro-N-(2,3-dimethyl-5-sulfamoylphenyl)-2-methylpropanamide
CID 62727374
2-(4-bromophenoxy)-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide
CID 9141449

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride?
The IUPAC name of N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride (CID 119689582) is N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride.
What is the SMILES notation for N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride?
The canonical SMILES for N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride is CNCC(=O)Nc1cc(S(N)(=O)=O)cc(C)c1C.Cl.
What is the InChIKey of N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride?
The InChIKey is XNUQPECFMBBRMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S.ClH/c1-7-4-9(18(12,16)17)5-10(8(7)2)14-11(15)6-13-3;/h4-5,13H,6H2,1-3H3,(H,14,15)(H2,12,16,17);1H.
What are the key properties of N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride?
N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride has a molecular weight of 307.80 g/mol, XLogP of 0.53, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethyl-5-sulfamoylphenyl)-2-(methylamino)acetamide;hydrochloride is sourced from PubChem (CID 119689582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).