N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide

C13H24N2O3S — CID 71984128

IUPACN-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide
SMILESCCN(CC)S(=O)(=O)CC(=O)NC1CC2CCC1C2
InChIInChI=1S/C13H24N2O3S/c1-3-15(4-2)19(17,18)9-13(16)14-12-8-10-5-6-11(12)7-10/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyFQLODBMENBIZHP-UHFFFAOYSA-N
MW288.41 g/mol
LogP0.96
Rot. Bonds6

About N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide

N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide (PubChem CID 71984128) has the molecular formula C13H24N2O3S and a molecular weight of 288.41 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide
PubChem CID71984128
Molecular FormulaC13H24N2O3S
Molecular Weight288.41 g/mol
Exact Mass288.15
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide
SMILESCCN(CC)S(=O)(=O)CC(=O)NC1CC2CCC1C2
InChIInChI=1S/C13H24N2O3S/c1-3-15(4-2)19(17,18)9-13(16)14-12-8-10-5-6-11(12)7-10/h10-12H,3-9H2,1-2H3,(H,14,16)
InChIKeyFQLODBMENBIZHP-UHFFFAOYSA-N
XLogP0.96
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.41
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]propanamide
CID 98230994
N-(2-bicyclo[2.2.1]heptanyl)-3-(diethylamino)propanamide
CID 3064442
3-(2-bicyclo[2.2.1]heptanyl)-1-ethyl-1-methylurea
CID 115642104
N-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-chloroacetamide
CID 14619230
N-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-methoxyacetamide
CID 96569471
N-(2-bicyclo[2.2.2]octanyl)-2-(diethylamino)acetamide
CID 24832141
N-(2-bicyclo[2.2.1]heptanyl)-4-[ethyl(ethylsulfonyl)amino]benzamide
CID 53289335
2-(diethylsulfamoyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119390469
2-[benzyl(methylsulfonyl)amino]-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]acetamide
CID 125057680
2-(2-bicyclo[2.2.1]heptanylamino)-1-fluoro-2-oxoethanesulfonic acid
CID 89458060
N-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-1-ethylsulfonylpiperidine-4-carboxamide
CID 95118913
[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]urea
CID 98511353

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide (CID 71984128) is N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide is CCN(CC)S(=O)(=O)CC(=O)NC1CC2CCC1C2.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide?
The InChIKey is FQLODBMENBIZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3S/c1-3-15(4-2)19(17,18)9-13(16)14-12-8-10-5-6-11(12)7-10/h10-12H,3-9H2,1-2H3,(H,14,16).
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide?
N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide has a molecular weight of 288.41 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)-2-(diethylsulfamoyl)acetamide is sourced from PubChem (CID 71984128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).