N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide

C16H24N2O4S — CID 47075400

IUPACN-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
SMILESCCN(CC1CCCO1)S(=O)(=O)c1cc(NC(C)=O)ccc1C
InChIInChI=1S/C16H24N2O4S/c1-4-18(11-15-6-5-9-22-15)23(20,21)16-10-14(17-13(3)19)8-7-12(16)2/h7-8,10,15H,4-6,9,11H2,1-3H3,(H,17,19)
InChIKeyCKWSKEILORRXKE-UHFFFAOYSA-N
MW340.45 g/mol
LogP2.14
Rot. Bonds6

About N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide

N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide (PubChem CID 47075400) has the molecular formula C16H24N2O4S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
PubChem CID47075400
Molecular FormulaC16H24N2O4S
Molecular Weight340.45 g/mol
Exact Mass340.15
IUPAC NameN-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide
SMILESCCN(CC1CCCO1)S(=O)(=O)c1cc(NC(C)=O)ccc1C
InChIInChI=1S/C16H24N2O4S/c1-4-18(11-15-6-5-9-22-15)23(20,21)16-10-14(17-13(3)19)8-7-12(16)2/h7-8,10,15H,4-6,9,11H2,1-3H3,(H,17,19)
InChIKeyCKWSKEILORRXKE-UHFFFAOYSA-N
XLogP2.14
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
The IUPAC name of N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide (CID 47075400) is N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide.
What is the SMILES notation for N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
The canonical SMILES for N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide is CCN(CC1CCCO1)S(=O)(=O)c1cc(NC(C)=O)ccc1C.
What is the InChIKey of N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
The InChIKey is CKWSKEILORRXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O4S/c1-4-18(11-15-6-5-9-22-15)23(20,21)16-10-14(17-13(3)19)8-7-12(16)2/h7-8,10,15H,4-6,9,11H2,1-3H3,(H,17,19).
What are the key properties of N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide?
N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide has a molecular weight of 340.45 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[ethyl(oxolan-2-ylmethyl)sulfamoyl]-4-methylphenyl]acetamide is sourced from PubChem (CID 47075400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).