1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene

C11H16N2O4S — CID 94281798

IUPAC1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene
SMILESCOc1ccccc1C(=O)CNS(=O)(=O)N(C)C
InChIInChI=1S/C11H16N2O4S/c1-13(2)18(15,16)12-8-10(14)9-6-4-5-7-11(9)17-3/h4-7,12H,8H2,1-3H3
InChIKeyNMPLVOFBIGWGKK-UHFFFAOYSA-N
MW272.33 g/mol
LogP0.27
Rot. Bonds6

About 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene

1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene (PubChem CID 94281798) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene.

Molecular Properties

Compound Name1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene
PubChem CID94281798
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene
SMILESCOc1ccccc1C(=O)CNS(=O)(=O)N(C)C
InChIInChI=1S/C11H16N2O4S/c1-13(2)18(15,16)12-8-10(14)9-6-4-5-7-11(9)17-3/h4-7,12H,8H2,1-3H3
InChIKeyNMPLVOFBIGWGKK-UHFFFAOYSA-N
XLogP0.27
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
N-[2-(2-methoxyphenyl)-2-oxoethyl]acetamide
CID 12945637
1-(2-methoxyphenyl)-2-(2,4,4-trimethylpentan-2-ylamino)ethanone
CID 82102169
3-(2-methoxyphenyl)-3-oxopropane-1-sulfonic acid
CID 94688299
2-fluoro-1-(2-methoxyphenyl)ethanone
CID 11816076
N-[2-(2-methoxyphenyl)-2-oxoethyl]butanamide
CID 94262493
2-(2-fluoroanilino)-1-(2-methoxyphenyl)ethanone
CID 94272670
N-[2-(dimethylsulfamoylamino)ethyl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 113054972
N-[2-(dimethylsulfamoylamino)ethyl]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 113055867
N-formyl-N-[2-(2-methoxyphenyl)-2-oxoethyl]formamide
CID 86593207
1-(2-methoxyphenyl)-2-(3-methylanilino)ethanone
CID 94271270
2-methoxybenzohydrazide
CID 24051

Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene?
The IUPAC name of 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene (CID 94281798) is 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene.
What is the SMILES notation for 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene?
The canonical SMILES for 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene is COc1ccccc1C(=O)CNS(=O)(=O)N(C)C.
What is the InChIKey of 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene?
The InChIKey is NMPLVOFBIGWGKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-13(2)18(15,16)12-8-10(14)9-6-4-5-7-11(9)17-3/h4-7,12H,8H2,1-3H3.
What are the key properties of 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene?
1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene has a molecular weight of 272.33 g/mol, XLogP of 0.27, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylsulfamoylamino)acetyl]-2-methoxybenzene is sourced from PubChem (CID 94281798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).