N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide

C13H18N2O4S — CID 82921293

IUPACN-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCC2CC2)c(S(N)(=O)=O)c1
InChIInChI=1S/C13H18N2O4S/c1-9-2-5-11(12(6-9)20(14,17)18)19-8-13(16)15-7-10-3-4-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,15,16)(H2,14,17,18)
InChIKeyCTAXDFWWXJFNTN-UHFFFAOYSA-N
MW298.36 g/mol
LogP0.55
Rot. Bonds6

About N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide

N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide (PubChem CID 82921293) has the molecular formula C13H18N2O4S and a molecular weight of 298.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide
PubChem CID82921293
Molecular FormulaC13H18N2O4S
Molecular Weight298.36 g/mol
Exact Mass298.10
IUPAC NameN-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)NCC2CC2)c(S(N)(=O)=O)c1
InChIInChI=1S/C13H18N2O4S/c1-9-2-5-11(12(6-9)20(14,17)18)19-8-13(16)15-7-10-3-4-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,15,16)(H2,14,17,18)
InChIKeyCTAXDFWWXJFNTN-UHFFFAOYSA-N
XLogP0.55
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide 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

2-[2-(cyclopropylmethylamino)-2-oxoethoxy]-5-methylbenzenesulfonyl chloride
CID 82909707
N-(cyclopropylmethyl)-2-(2,3-dimethyl-4-sulfamoylphenoxy)acetamide
CID 82913298
2-(2-bromo-4-methylphenoxy)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106123697
N-(3-methylbutan-2-yl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide
CID 82914156
5-chloro-2-[2-(cyclopropylmethylamino)-2-oxoethoxy]benzenesulfonyl chloride
CID 82921961
2-(4-bromo-2-sulfamoylphenoxy)-N-ethylacetamide
CID 82914401
N-(cyclopropylmethyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 112810655
3-bromo-4-[2-(cyclopropylmethylamino)-2-oxoethoxy]benzenesulfonyl chloride
CID 82910326
2-(2,4-dimethylphenoxy)-N-(piperidin-3-ylmethyl)acetamide
CID 119462971
N-(cyclopropylmethyl)-2-[4-(4-methylphenoxy)phenoxy]acetamide
CID 24667225
2-(2-amino-4-bromophenoxy)-N-(cyclopropylmethyl)acetamide
CID 65430722
2-(5-carbamothioyl-2-methylphenoxy)-N-(cyclopropylmethyl)acetamide
CID 107656363

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide (CID 82921293) is N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide is Cc1ccc(OCC(=O)NCC2CC2)c(S(N)(=O)=O)c1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide?
The InChIKey is CTAXDFWWXJFNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4S/c1-9-2-5-11(12(6-9)20(14,17)18)19-8-13(16)15-7-10-3-4-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,15,16)(H2,14,17,18).
What are the key properties of N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide?
N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide has a molecular weight of 298.36 g/mol, XLogP of 0.55, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(4-methyl-2-sulfamoylphenoxy)acetamide is sourced from PubChem (CID 82921293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).