2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide

C16H17ClN2O4S — CID 31916474

IUPAC2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)NCc1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C16H17ClN2O4S/c1-11-7-13(17)5-6-15(11)23-10-16(20)19-9-12-3-2-4-14(8-12)24(18,21)22/h2-8H,9-10H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyLWYKDZYTTIUUKP-UHFFFAOYSA-N
MW368.84 g/mol
LogP1.99
Rot. Bonds6

About 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide

2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide (PubChem CID 31916474) has the molecular formula C16H17ClN2O4S and a molecular weight of 368.84 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide
PubChem CID31916474
Molecular FormulaC16H17ClN2O4S
Molecular Weight368.84 g/mol
Exact Mass368.06
IUPAC Name2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide
SMILESCc1cc(Cl)ccc1OCC(=O)NCc1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C16H17ClN2O4S/c1-11-7-13(17)5-6-15(11)23-10-16(20)19-9-12-3-2-4-14(8-12)24(18,21)22/h2-8H,9-10H2,1H3,(H,19,20)(H2,18,21,22)
InChIKeyLWYKDZYTTIUUKP-UHFFFAOYSA-N
XLogP1.99
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.84
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]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-(4-chloro-2-methylphenoxy)-N-[[3-[(3-fluorophenyl)methylsulfamoyl]phenyl]methyl]acetamide
CID 55945767
2-(4-chloro-2-methylphenoxy)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 2683015
N-[3-[[[2-(4-chloro-2-methylphenoxy)acetyl]amino]methyl]phenyl]-2-methylpropanamide
CID 33014645
2-methoxy-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 32567500
2-(4-chloro-2-methylphenoxy)-N-[[3-(2,2,2-trifluoroethoxy)phenyl]methyl]acetamide
CID 55712262
2-(4-chloro-2-methylphenoxy)-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 3907497
2-(4-chloro-2-methylphenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 3624933
4-(4-chloro-2-methylphenoxy)-N-(3-sulfamoylphenyl)butanamide
CID 26580576
2-(2,4-dichlorophenoxy)-N-(3-sulfamoylphenyl)acetamide
CID 9413124
2-(2-methyl-4-sulfamoylphenoxy)-N-prop-2-ynylacetamide
CID 82921954
2-(2-bromo-4-chlorophenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 1289065
2-(4-chloro-2-methylphenoxy)-N-(4-methylphenyl)sulfonylacetamide
CID 14870431

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide (CID 31916474) is 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide is Cc1cc(Cl)ccc1OCC(=O)NCc1cccc(S(N)(=O)=O)c1.
What is the InChIKey of 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide?
The InChIKey is LWYKDZYTTIUUKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O4S/c1-11-7-13(17)5-6-15(11)23-10-16(20)19-9-12-3-2-4-14(8-12)24(18,21)22/h2-8H,9-10H2,1H3,(H,19,20)(H2,18,21,22).
What are the key properties of 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide?
2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide has a molecular weight of 368.84 g/mol, XLogP of 1.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenoxy)-N-[(3-sulfamoylphenyl)methyl]acetamide is sourced from PubChem (CID 31916474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).