N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide

C12H16N2O3S — CID 39764000

IUPACN-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide
SMILESCc1ccc(NC(=O)C2CCC2)cc1S(N)(=O)=O
InChIInChI=1S/C12H16N2O3S/c1-8-5-6-10(7-11(8)18(13,16)17)14-12(15)9-3-2-4-9/h5-7,9H,2-4H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyOJRSFFYLMYYSQU-UHFFFAOYSA-N
MW268.34 g/mol
LogP1.38
Rot. Bonds3

About N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide

N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide (PubChem CID 39764000) has the molecular formula C12H16N2O3S and a molecular weight of 268.34 g/mol. Its IUPAC name is N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide
PubChem CID39764000
Molecular FormulaC12H16N2O3S
Molecular Weight268.34 g/mol
Exact Mass268.09
IUPAC NameN-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide
SMILESCc1ccc(NC(=O)C2CCC2)cc1S(N)(=O)=O
InChIInChI=1S/C12H16N2O3S/c1-8-5-6-10(7-11(8)18(13,16)17)14-12(15)9-3-2-4-9/h5-7,9H,2-4H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyOJRSFFYLMYYSQU-UHFFFAOYSA-N
XLogP1.38
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopropanecarbonylamino)-N-(4-methyl-3-sulfamoylphenyl)benzamide
CID 46809533
N-[4-methyl-3-(methylsulfamoyl)phenyl]cyclohexanecarboxamide
CID 78788592
2-amino-N-(4-methyl-3-sulfamoylphenyl)cyclohexane-1-carboxamide
CID 64823639
N-[3-[(4-chlorophenyl)sulfamoyl]-4-methylphenyl]cyclobutanecarboxamide
CID 9243824
N-(4-ethoxy-3-sulfamoylphenyl)cyclobutanecarboxamide
CID 43134013
N-(4-methyl-3-sulfamoylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 78983436
4-N-(4-methyl-3-sulfamoylphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 55363749
N-(4-methyl-3-sulfamoylphenyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 47048097
N-(4-methyl-3-sulfamoylphenyl)oxane-2-carboxamide
CID 62213044
N-(3-methyl-4-sulfamoylphenyl)oxane-3-carboxamide
CID 63015081
3-amino-N-[3-(cyclopropylsulfamoyl)-4-methylphenyl]cyclohexane-1-carboxamide
CID 119797379
1-methyl-N-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)piperidine-4-carboxamide
CID 50875261

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide?
The IUPAC name of N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide (CID 39764000) is N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide.
What is the SMILES notation for N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide?
The canonical SMILES for N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide is Cc1ccc(NC(=O)C2CCC2)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide?
The InChIKey is OJRSFFYLMYYSQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3S/c1-8-5-6-10(7-11(8)18(13,16)17)14-12(15)9-3-2-4-9/h5-7,9H,2-4H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide?
N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide has a molecular weight of 268.34 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-sulfamoylphenyl)cyclobutanecarboxamide is sourced from PubChem (CID 39764000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).