N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide

C13H18N2O4S — CID 65159263

IUPACN-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide
SMILESCN(C(=O)CC1CCCO1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H18N2O4S/c1-15(13(16)9-11-3-2-8-19-11)10-4-6-12(7-5-10)20(14,17)18/h4-7,11H,2-3,8-9H2,1H3,(H2,14,17,18)
InChIKeyWRKWRPXJAVHANV-UHFFFAOYSA-N
MW298.36 g/mol
LogP0.87
Rot. Bonds4

About N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide

N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide (PubChem CID 65159263) has the molecular formula C13H18N2O4S and a molecular weight of 298.36 g/mol. Its IUPAC name is N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide
PubChem CID65159263
Molecular FormulaC13H18N2O4S
Molecular Weight298.36 g/mol
Exact Mass298.10
IUPAC NameN-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide
SMILESCN(C(=O)CC1CCCO1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C13H18N2O4S/c1-15(13(16)9-11-3-2-8-19-11)10-4-6-12(7-5-10)20(14,17)18/h4-7,11H,2-3,8-9H2,1H3,(H2,14,17,18)
InChIKeyWRKWRPXJAVHANV-UHFFFAOYSA-N
XLogP0.87
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-(4-sulfamoylphenyl)-2-(thian-4-yl)acetamide
CID 83138068
3-cyclopentyl-N-methyl-N-(4-sulfamoylphenyl)propanamide
CID 61130763
N-(4-aminophenyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 65152624
2-(oxolan-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 60769664
N-(2-methyl-5-sulfamoylphenyl)-2-(oxolan-2-yl)acetamide
CID 65159878
3-[(2R)-oxolan-2-yl]-N-[(4-sulfamoylphenyl)methyl]propanamide
CID 94097094
4-(oxolan-2-ylmethylsulfonylamino)benzenesulfonamide
CID 63247383
2-(4-methyl-N-[2-(oxolan-2-yl)acetyl]anilino)acetic acid
CID 65157371
[(2R)-oxolan-2-yl]methyl 4-(dimethylsulfamoyl)benzoate
CID 2375035
3-[acetyl(oxolan-2-ylmethyl)amino]-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
CID 113117302
N-[4-(dimethylamino)phenyl]-2-(oxolan-2-yl)acetamide
CID 110696648
N,2,2-trimethyl-N-(4-sulfamoylphenyl)cyclopentane-1-carboxamide
CID 107182878

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide?
The IUPAC name of N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide (CID 65159263) is N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide.
What is the SMILES notation for N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide?
The canonical SMILES for N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide is CN(C(=O)CC1CCCO1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide?
The InChIKey is WRKWRPXJAVHANV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4S/c1-15(13(16)9-11-3-2-8-19-11)10-4-6-12(7-5-10)20(14,17)18/h4-7,11H,2-3,8-9H2,1H3,(H2,14,17,18).
What are the key properties of N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide?
N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide has a molecular weight of 298.36 g/mol, XLogP of 0.87, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-2-yl)-N-(4-sulfamoylphenyl)acetamide is sourced from PubChem (CID 65159263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).