2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide

C17H25ClN2O3S — CID 113068154

IUPAC2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide
SMILESCS(=O)(=O)N(CCNC(=O)c1ccccc1Cl)C1CCCCCC1
InChIInChI=1S/C17H25ClN2O3S/c1-24(22,23)20(14-8-4-2-3-5-9-14)13-12-19-17(21)15-10-6-7-11-16(15)18/h6-7,10-11,14H,2-5,8-9,12-13H2,1H3,(H,19,21)
InChIKeyHUUXCODNQMOAET-UHFFFAOYSA-N
MW372.92 g/mol
LogP3.05
Rot. Bonds6

About 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide

2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide (PubChem CID 113068154) has the molecular formula C17H25ClN2O3S and a molecular weight of 372.92 g/mol. Its IUPAC name is 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide
PubChem CID113068154
Molecular FormulaC17H25ClN2O3S
Molecular Weight372.92 g/mol
Exact Mass372.13
IUPAC Name2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide
SMILESCS(=O)(=O)N(CCNC(=O)c1ccccc1Cl)C1CCCCCC1
InChIInChI=1S/C17H25ClN2O3S/c1-24(22,23)20(14-8-4-2-3-5-9-14)13-12-19-17(21)15-10-6-7-11-16(15)18/h6-7,10-11,14H,2-5,8-9,12-13H2,1H3,(H,19,21)
InChIKeyHUUXCODNQMOAET-UHFFFAOYSA-N
XLogP3.05
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.92
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]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

N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]-2-(2-fluorophenyl)acetamide
CID 113068164
2-(4-chlorophenyl)-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]acetamide
CID 113068149
2-chloro-N-[2-[cyclohexyl(methylsulfonyl)amino]ethyl]benzenesulfonamide
CID 113065880
N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide
CID 113068124
N-[2-[cyclohexyl(methylsulfonyl)amino]ethyl]cyclopropanecarboxamide
CID 113065794
N-[2-[cyclopentyl(methylsulfonyl)amino]ethyl]cyclohexanecarboxamide
CID 113065694
N-[2-[cyclohexyl(methylsulfonyl)amino]ethyl]-3,4-difluorobenzamide
CID 113065838
N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]-2-ethylbutanamide
CID 113068127
N-[2-[cyclohexyl(methylsulfonyl)amino]ethyl]-2-(3-fluorophenyl)acetamide
CID 113065842
2-(4-chlorophenyl)-N-[2-[cyclopropyl(methylsulfonyl)amino]ethyl]acetamide
CID 113065117
N-[2-(cyclohexanecarbonylamino)ethyl]-2-methylbenzamide
CID 108538982
1-cyclohexyl-3-[2-[cyclopentyl(methylsulfonyl)amino]ethyl]urea
CID 113065748

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide (CID 113068154) is 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide is CS(=O)(=O)N(CCNC(=O)c1ccccc1Cl)C1CCCCCC1.
What is the InChIKey of 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide?
The InChIKey is HUUXCODNQMOAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2O3S/c1-24(22,23)20(14-8-4-2-3-5-9-14)13-12-19-17(21)15-10-6-7-11-16(15)18/h6-7,10-11,14H,2-5,8-9,12-13H2,1H3,(H,19,21).
What are the key properties of 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide?
2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide has a molecular weight of 372.92 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-[cycloheptyl(methylsulfonyl)amino]ethyl]benzamide is sourced from PubChem (CID 113068154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).