5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide

C19H22N2O4S — CID 32934577

IUPAC5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NCCOc1ccccc1
InChIInChI=1S/C19H22N2O4S/c1-14-7-10-17(26(23,24)21-15-8-9-15)13-18(14)19(22)20-11-12-25-16-5-3-2-4-6-16/h2-7,10,13,15,21H,8-9,11-12H2,1H3,(H,20,22)
InChIKeyDPAOTENGRCSQAG-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.24
Rot. Bonds8

About 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide

5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide (PubChem CID 32934577) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide.

Molecular Properties

Compound Name5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide
PubChem CID32934577
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC Name5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide
SMILESCc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NCCOc1ccccc1
InChIInChI=1S/C19H22N2O4S/c1-14-7-10-17(26(23,24)21-15-8-9-15)13-18(14)19(22)20-11-12-25-16-5-3-2-4-6-16/h2-7,10,13,15,21H,8-9,11-12H2,1H3,(H,20,22)
InChIKeyDPAOTENGRCSQAG-UHFFFAOYSA-N
XLogP2.24
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide?
The IUPAC name of 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide (CID 32934577) is 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide.
What is the SMILES notation for 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide?
The canonical SMILES for 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide is Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NCCOc1ccccc1.
What is the InChIKey of 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide?
The InChIKey is DPAOTENGRCSQAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-14-7-10-17(26(23,24)21-15-8-9-15)13-18(14)19(22)20-11-12-25-16-5-3-2-4-6-16/h2-7,10,13,15,21H,8-9,11-12H2,1H3,(H,20,22).
What are the key properties of 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide?
5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide has a molecular weight of 374.46 g/mol, XLogP of 2.24, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylsulfamoyl)-2-methyl-N-(2-phenoxyethyl)benzamide is sourced from PubChem (CID 32934577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).