2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide

C23H27ClN2O3S — CID 60522229

IUPAC2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C2CC2)C2CCc3ccccc32)c1
InChIInChI=1S/C23H27ClN2O3S/c1-3-25(4-2)30(28,29)18-12-13-21(24)20(15-18)23(27)26(17-10-11-17)22-14-9-16-7-5-6-8-19(16)22/h5-8,12-13,15,17,22H,3-4,9-11,14H2,1-2H3
InChIKeyFNFGCDVIHAIALN-UHFFFAOYSA-N
MW447.00 g/mol
LogP4.66
Rot. Bonds7

About 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide

2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide (PubChem CID 60522229) has the molecular formula C23H27ClN2O3S and a molecular weight of 447.00 g/mol. Its IUPAC name is 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide
PubChem CID60522229
Molecular FormulaC23H27ClN2O3S
Molecular Weight447.00 g/mol
Exact Mass446.14
IUPAC Name2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C2CC2)C2CCc3ccccc32)c1
InChIInChI=1S/C23H27ClN2O3S/c1-3-25(4-2)30(28,29)18-12-13-21(24)20(15-18)23(27)26(17-10-11-17)22-14-9-16-7-5-6-8-19(16)22/h5-8,12-13,15,17,22H,3-4,9-11,14H2,1-2H3
InChIKeyFNFGCDVIHAIALN-UHFFFAOYSA-N
XLogP4.66
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500447.00
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide 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 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide?
The IUPAC name of 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide (CID 60522229) is 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide.
What is the SMILES notation for 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide?
The canonical SMILES for 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide is CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)N(C2CC2)C2CCc3ccccc32)c1.
What is the InChIKey of 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide?
The InChIKey is FNFGCDVIHAIALN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27ClN2O3S/c1-3-25(4-2)30(28,29)18-12-13-21(24)20(15-18)23(27)26(17-10-11-17)22-14-9-16-7-5-6-8-19(16)22/h5-8,12-13,15,17,22H,3-4,9-11,14H2,1-2H3.
What are the key properties of 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide?
2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide has a molecular weight of 447.00 g/mol, XLogP of 4.66, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-cyclopropyl-5-(diethylsulfamoyl)-N-(2,3-dihydro-1H-inden-1-yl)benzamide is sourced from PubChem (CID 60522229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).