4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide

C15H22N2O3S — CID 79359507

IUPAC4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
SMILESCC1(C)C(CNC(=O)c2ccc(S(N)(=O)=O)cc2)C1(C)C
InChIInChI=1S/C15H22N2O3S/c1-14(2)12(15(14,3)4)9-17-13(18)10-5-7-11(8-6-10)21(16,19)20/h5-8,12H,9H2,1-4H3,(H,17,18)(H2,16,19,20)
InChIKeyKCTRLMHNJNNALA-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.75
Rot. Bonds4

About 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide

4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide (PubChem CID 79359507) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide.

Molecular Properties

Compound Name4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
PubChem CID79359507
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC Name4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
SMILESCC1(C)C(CNC(=O)c2ccc(S(N)(=O)=O)cc2)C1(C)C
InChIInChI=1S/C15H22N2O3S/c1-14(2)12(15(14,3)4)9-17-13(18)10-5-7-11(8-6-10)21(16,19)20/h5-8,12H,9H2,1-4H3,(H,17,18)(H2,16,19,20)
InChIKeyKCTRLMHNJNNALA-UHFFFAOYSA-N
XLogP1.75
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2,2,3,3-tetramethylcyclopropyl)methylcarbamoyl]benzenesulfonyl chloride
CID 79360136
N-ethyl-4-sulfamoylbenzamide
CID 10242881
N-(cyclobutylmethyl)-4-sulfamoylbenzamide
CID 43298916
4-amino-3-bromo-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
CID 79362346
N-ethyl-4-sulfamoylbenzamide;N-methylmethanamine
CID 68596264
N-[(1-methylcyclopentyl)methyl]-4-sulfamoylbenzamide
CID 63821642
3-amino-4-bromo-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide
CID 79352767
N-[(1-methylcyclohexyl)methyl]-4-sulfamoylbenzamide
CID 103754265
N-(3-oxobutyl)-4-sulfamoylbenzamide
CID 23579196
N-(2-methyl-2-methylsulfonylpropyl)-4-sulfamoylbenzamide
CID 79559148
N-butylbutan-1-amine;N-propyl-4-sulfamoylbenzamide
CID 68610816
N-methylethanamine;N-propyl-4-sulfamoylbenzamide
CID 68599383

Frequently Asked Questions

What is the IUPAC name of 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide?
The IUPAC name of 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide (CID 79359507) is 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide.
What is the SMILES notation for 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide?
The canonical SMILES for 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide is CC1(C)C(CNC(=O)c2ccc(S(N)(=O)=O)cc2)C1(C)C.
What is the InChIKey of 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide?
The InChIKey is KCTRLMHNJNNALA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-14(2)12(15(14,3)4)9-17-13(18)10-5-7-11(8-6-10)21(16,19)20/h5-8,12H,9H2,1-4H3,(H,17,18)(H2,16,19,20).
What are the key properties of 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide?
4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide has a molecular weight of 310.42 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]benzamide is sourced from PubChem (CID 79359507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).