N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide

C17H25N3O4S — CID 10666666

IUPACN-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide
SMILESCC(=O)NCCc1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C17H25N3O4S/c1-13(21)18-12-11-14-7-9-16(10-8-14)25(23,24)20-17(22)19-15-5-3-2-4-6-15/h7-10,15H,2-6,11-12H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyIMMFXSGHFKGGMO-UHFFFAOYSA-N
MW367.47 g/mol
LogP1.69
Rot. Bonds6

About N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide

N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide (PubChem CID 10666666) has the molecular formula C17H25N3O4S and a molecular weight of 367.47 g/mol. Its IUPAC name is N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide
PubChem CID10666666
Molecular FormulaC17H25N3O4S
Molecular Weight367.47 g/mol
Exact Mass367.16
IUPAC NameN-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide
SMILESCC(=O)NCCc1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C17H25N3O4S/c1-13(21)18-12-11-14-7-9-16(10-8-14)25(23,24)20-17(22)19-15-5-3-2-4-6-15/h7-10,15H,2-6,11-12H2,1H3,(H,18,21)(H2,19,20,22)
InChIKeyIMMFXSGHFKGGMO-UHFFFAOYSA-N
XLogP1.69
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.47
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2,3,4,5,6-pentafluorobenzamide
CID 10346554
1-cyclohexyl-3-(4-ethylphenyl)sulfonylurea
CID 10495173
N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]ethanimidate
CID 100950927
methyl 5-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethylcarbamoyl]pyrazine-2-carboxylate
CID 59767886
1-cyclopentyl-3-[2-(4-ethylsulfonylphenyl)ethyl]urea
CID 110776114
3-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-1-methyl-1-pyridin-2-ylurea
CID 21433328
N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxy-5-methylbenzamide
CID 44567440
cerium;5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxybenzamide
CID 88767103
3-[2-[4-(cycloheptylcarbamoylsulfamoyl)phenyl]ethyl]-1-methyl-1-quinolin-2-ylurea
CID 21433308
N-[4-[2-[4-[(4-methylcyclohexyl)carbamoylsulfamoyl]phenyl]ethylsulfamoyl]phenyl]acetamide
CID 44565017
N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-3-oxo-1H-isoindole-2-carboxamide;methoxymethane
CID 21162344
N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2,5-dimethyl-2,3-dihydro-1-benzofuran-7-carboxamide
CID 163449069

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide?
The IUPAC name of N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide (CID 10666666) is N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide.
What is the SMILES notation for N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide?
The canonical SMILES for N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide is CC(=O)NCCc1ccc(S(=O)(=O)NC(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide?
The InChIKey is IMMFXSGHFKGGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O4S/c1-13(21)18-12-11-14-7-9-16(10-8-14)25(23,24)20-17(22)19-15-5-3-2-4-6-15/h7-10,15H,2-6,11-12H2,1H3,(H,18,21)(H2,19,20,22).
What are the key properties of N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide?
N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide has a molecular weight of 367.47 g/mol, XLogP of 1.69, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]acetamide is sourced from PubChem (CID 10666666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).