2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide

C11H22N2O3S — CID 107182865

IUPAC2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide
SMILESCC1(C)CCCCC1C(=O)NCCS(N)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-11(2)6-4-3-5-9(11)10(14)13-7-8-17(12,15)16/h9H,3-8H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyITDLWGKJZRWAJF-UHFFFAOYSA-N
MW262.37 g/mol
LogP0.61
Rot. Bonds4

About 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide

2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide (PubChem CID 107182865) has the molecular formula C11H22N2O3S and a molecular weight of 262.37 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide
PubChem CID107182865
Molecular FormulaC11H22N2O3S
Molecular Weight262.37 g/mol
Exact Mass262.14
IUPAC Name2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide
SMILESCC1(C)CCCCC1C(=O)NCCS(N)(=O)=O
InChIInChI=1S/C11H22N2O3S/c1-11(2)6-4-3-5-9(11)10(14)13-7-8-17(12,15)16/h9H,3-8H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyITDLWGKJZRWAJF-UHFFFAOYSA-N
XLogP0.61
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.37
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloropropyl)-2,2-dimethylcyclohexane-1-carboxamide
CID 107179984
N-(3-hydroxybutyl)-2,2-dimethylcyclohexane-1-carboxamide
CID 107180369
N-hydroxy-2,2-dimethylcyclohexane-1-carboxamide
CID 87324456
2,2-dimethyl-N-(2-oxopropyl)cyclohexane-1-carboxamide
CID 107178834
N-[[1-(aminomethyl)cyclopropyl]methyl]-2,2-dimethylcyclohexane-1-carboxamide
CID 107184694
N-(4-bromopentyl)-2,2-dimethylcyclohexane-1-carboxamide
CID 106131588
N-(4-bromobutyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107184530
(1S)-2,2-dimethylcyclohexane-1-carboxamide
CID 90019535
N-(4-amino-2,2-dimethylbutyl)-2,2-dimethylcyclohexane-1-carboxamide
CID 114148900
N-(2-amino-2-ethylbutyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107181003
N-[[2-(bromomethyl)cyclohexyl]methyl]-2,2-dimethylcyclohexane-1-carboxamide
CID 107184222
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2,2-dimethylcyclohexane-1-carboxamide
CID 114008358

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide (CID 107182865) is 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide is CC1(C)CCCCC1C(=O)NCCS(N)(=O)=O.
What is the InChIKey of 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide?
The InChIKey is ITDLWGKJZRWAJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S/c1-11(2)6-4-3-5-9(11)10(14)13-7-8-17(12,15)16/h9H,3-8H2,1-2H3,(H,13,14)(H2,12,15,16).
What are the key properties of 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide?
2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide has a molecular weight of 262.37 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2-sulfamoylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 107182865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).