4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide

C19H28N2O4S — CID 109059992

IUPAC4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide
SMILESO=C(NCC1CCCO1)c1ccc(S(=O)(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C19H28N2O4S/c22-19(20-14-17-8-5-13-25-17)15-9-11-18(12-10-15)26(23,24)21-16-6-3-1-2-4-7-16/h9-12,16-17,21H,1-8,13-14H2,(H,20,22)
InChIKeyDSSYDQLWLAMLGD-UHFFFAOYSA-N
MW380.51 g/mol
LogP2.60
Rot. Bonds6

About 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide

4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 109059992) has the molecular formula C19H28N2O4S and a molecular weight of 380.51 g/mol. Its IUPAC name is 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide
PubChem CID109059992
Molecular FormulaC19H28N2O4S
Molecular Weight380.51 g/mol
Exact Mass380.18
IUPAC Name4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide
SMILESO=C(NCC1CCCO1)c1ccc(S(=O)(=O)NC2CCCCCC2)cc1
InChIInChI=1S/C19H28N2O4S/c22-19(20-14-17-8-5-13-25-17)15-9-11-18(12-10-15)26(23,24)21-16-6-3-1-2-4-7-16/h9-12,16-17,21H,1-8,13-14H2,(H,20,22)
InChIKeyDSSYDQLWLAMLGD-UHFFFAOYSA-N
XLogP2.60
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.51
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide 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

3-(cyclopropylsulfamoyl)-4-fluoro-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 95150216
4-[(2-fluorophenyl)sulfamoyl]-N-(oxolan-2-ylmethyl)benzamide
CID 24980882
4-[(3,4-dimethylphenyl)sulfamoyl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 25391523
4-[(4-ethoxyphenyl)sulfonylamino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 26871354
N-(oxolan-2-ylmethyl)-4-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109059990
4-(cyclohexylcarbamoylamino)-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 42579542
N-cyclopropyl-4-(oxolan-2-ylmethylamino)benzenesulfonamide
CID 43454039
5-(cyclohexylsulfamoyl)-2-[[(2S)-oxolan-2-yl]methylamino]benzoic acid
CID 99983158
N-cyclopropyl-4-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 51163666
4-amino-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 723405
4-fluoro-N-(oxolan-2-ylmethyl)benzamide
CID 531952
4-iodo-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 875708

Frequently Asked Questions

What is the IUPAC name of 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide?
The IUPAC name of 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide (CID 109059992) is 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide?
The canonical SMILES for 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide is O=C(NCC1CCCO1)c1ccc(S(=O)(=O)NC2CCCCCC2)cc1.
What is the InChIKey of 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide?
The InChIKey is DSSYDQLWLAMLGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4S/c22-19(20-14-17-8-5-13-25-17)15-9-11-18(12-10-15)26(23,24)21-16-6-3-1-2-4-7-16/h9-12,16-17,21H,1-8,13-14H2,(H,20,22).
What are the key properties of 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide?
4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 380.51 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cycloheptylsulfamoyl)-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 109059992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).