N-(2-methylpropyl)cyclohexene-1-sulfonamide

C10H19NO2S — CID 18792230

IUPACN-(2-methylpropyl)cyclohexene-1-sulfonamide
SMILESCC(C)CNS(=O)(=O)C1=CCCCC1
InChIInChI=1S/C10H19NO2S/c1-9(2)8-11-14(12,13)10-6-4-3-5-7-10/h6,9,11H,3-5,7-8H2,1-2H3
InChIKeyXUKBHAZBQJWQRG-UHFFFAOYSA-N
MW217.33 g/mol
LogP2.02
Rot. Bonds4

About N-(2-methylpropyl)cyclohexene-1-sulfonamide

N-(2-methylpropyl)cyclohexene-1-sulfonamide (PubChem CID 18792230) has the molecular formula C10H19NO2S and a molecular weight of 217.33 g/mol. Its IUPAC name is N-(2-methylpropyl)cyclohexene-1-sulfonamide.

Molecular Properties

Compound NameN-(2-methylpropyl)cyclohexene-1-sulfonamide
PubChem CID18792230
Molecular FormulaC10H19NO2S
Molecular Weight217.33 g/mol
Exact Mass217.11
IUPAC NameN-(2-methylpropyl)cyclohexene-1-sulfonamide
SMILESCC(C)CNS(=O)(=O)C1=CCCCC1
InChIInChI=1S/C10H19NO2S/c1-9(2)8-11-14(12,13)10-6-4-3-5-7-10/h6,9,11H,3-5,7-8H2,1-2H3
InChIKeyXUKBHAZBQJWQRG-UHFFFAOYSA-N
XLogP2.02
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.33
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propan-2-ylcyclohexene-1-sulfonamide
CID 155332302
3-[2-(cyclohexen-1-yl)ethylsulfamoyl]-4-(2-methylpropylamino)benzoic acid
CID 99978499
1-[(2R)-butan-2-yl]cyclohexene
CID 13107632
2-(cyclohexen-1-yl)-3-ethyl-N-(2-methylpropyl)pentan-1-amine
CID 116662399
cyclohexene-1-sulfonate;1,1-dimethylpiperidin-1-ium
CID 88537122
2,4,6-trifluoro-N-(2-methylpropyl)benzenesulfonamide
CID 47358735
1-ethenylsulfonylcyclohexene
CID 67229963
N-(2-methylpropyl)-2-methylsulfonylbenzenesulfonamide
CID 86922498
4-(4-methylphenyl)-N-(2-methylpropyl)benzenesulfonamide
CID 70038697
2-(cyclohexen-1-yl)-N-(2-methylpropyl)-2-propylpentan-1-amine
CID 116662398
N-(2-methylpropylsulfamoyl)butan-2-amine
CID 114814896
N-(2-acetyl-5-phenylphenyl)cyclohexene-1-sulfonamide
CID 158569151

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)cyclohexene-1-sulfonamide?
The IUPAC name of N-(2-methylpropyl)cyclohexene-1-sulfonamide (CID 18792230) is N-(2-methylpropyl)cyclohexene-1-sulfonamide.
What is the SMILES notation for N-(2-methylpropyl)cyclohexene-1-sulfonamide?
The canonical SMILES for N-(2-methylpropyl)cyclohexene-1-sulfonamide is CC(C)CNS(=O)(=O)C1=CCCCC1.
What is the InChIKey of N-(2-methylpropyl)cyclohexene-1-sulfonamide?
The InChIKey is XUKBHAZBQJWQRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2S/c1-9(2)8-11-14(12,13)10-6-4-3-5-7-10/h6,9,11H,3-5,7-8H2,1-2H3.
What are the key properties of N-(2-methylpropyl)cyclohexene-1-sulfonamide?
N-(2-methylpropyl)cyclohexene-1-sulfonamide has a molecular weight of 217.33 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)cyclohexene-1-sulfonamide is sourced from PubChem (CID 18792230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).