N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide

C14H20N2O4S — CID 114631628

IUPACN-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NC2CC(O)C2(C)C)cc1
InChIInChI=1S/C14H20N2O4S/c1-9(17)15-10-4-6-11(7-5-10)21(19,20)16-12-8-13(18)14(12,2)3/h4-7,12-13,16,18H,8H2,1-3H3,(H,15,17)
InChIKeyUZDYETVVLZIOET-UHFFFAOYSA-N
MW312.39 g/mol
LogP1.08
Rot. Bonds4

About N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide

N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide (PubChem CID 114631628) has the molecular formula C14H20N2O4S and a molecular weight of 312.39 g/mol. Its IUPAC name is N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide
PubChem CID114631628
Molecular FormulaC14H20N2O4S
Molecular Weight312.39 g/mol
Exact Mass312.11
IUPAC NameN-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NC2CC(O)C2(C)C)cc1
InChIInChI=1S/C14H20N2O4S/c1-9(17)15-10-4-6-11(7-5-10)21(19,20)16-12-8-13(18)14(12,2)3/h4-7,12-13,16,18H,8H2,1-3H3,(H,15,17)
InChIKeyUZDYETVVLZIOET-UHFFFAOYSA-N
XLogP1.08
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 51.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-hydroxy-2,2-dimethylcyclobutyl)-4-propan-2-ylbenzenesulfonamide
CID 114631600
N-[4-[[(1R,2S,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]sulfamoyl]phenyl]acetamide
CID 23308718
4-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-methylbenzenesulfonamide
CID 112633693
6-chloro-N-(3-hydroxy-2,2-dimethylcyclobutyl)pyridine-3-sulfonamide
CID 114629375
N-(3-hydroxy-2,2-dimethylcyclobutyl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 114631487
N-(3-hydroxy-2,2-dimethylcyclobutyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 114631670
N-[4-[(3-aminocyclobutyl)sulfamoyl]phenyl]acetamide
CID 43597864
N-[4-[[(1S,2S)-2-hydroxycyclohexyl]sulfamoyl]phenyl]acetamide
CID 27059218
N-[4-[(4-acetamidophenyl)sulfonylsulfamoyl]phenyl]acetamide
CID 71349024
N-[4-[[(5R,6S)-6-hydroxy-1,3-dioxepan-5-yl]sulfamoyl]phenyl]acetamide
CID 67615689
4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]thiophene-2-carboxylic acid
CID 114628940
N-(3-hydroxy-2,2-dimethylcyclobutyl)-2-methylbenzenesulfonamide
CID 114631542

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide (CID 114631628) is N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NC2CC(O)C2(C)C)cc1.
What is the InChIKey of N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide?
The InChIKey is UZDYETVVLZIOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4S/c1-9(17)15-10-4-6-11(7-5-10)21(19,20)16-12-8-13(18)14(12,2)3/h4-7,12-13,16,18H,8H2,1-3H3,(H,15,17).
What are the key properties of N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide?
N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide has a molecular weight of 312.39 g/mol, XLogP of 1.08, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3-hydroxy-2,2-dimethylcyclobutyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 114631628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).