N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide

C11H18N2O3S2 — CID 112689693

IUPACN-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide
SMILESCc1sc(C(=O)NCC(C)(C)C)cc1S(N)(=O)=O
InChIInChI=1S/C11H18N2O3S2/c1-7-9(18(12,15)16)5-8(17-7)10(14)13-6-11(2,3)4/h5H,6H2,1-4H3,(H,13,14)(H2,12,15,16)
InChIKeyGDKQPMRWXHXOSH-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.48
Rot. Bonds3

About N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide

N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide (PubChem CID 112689693) has the molecular formula C11H18N2O3S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide
PubChem CID112689693
Molecular FormulaC11H18N2O3S2
Molecular Weight290.41 g/mol
Exact Mass290.08
IUPAC NameN-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide
SMILESCc1sc(C(=O)NCC(C)(C)C)cc1S(N)(=O)=O
InChIInChI=1S/C11H18N2O3S2/c1-7-9(18(12,15)16)5-8(17-7)10(14)13-6-11(2,3)4/h5H,6H2,1-4H3,(H,13,14)(H2,12,15,16)
InChIKeyGDKQPMRWXHXOSH-UHFFFAOYSA-N
XLogP1.48
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-(2-methylbutyl)-4-sulfamoylthiophene-2-carboxamide
CID 112676814
N-(2-cyclohexylethyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide
CID 115612428
2-methyl-5-(2,2,2-trifluoroethylcarbamoyl)thiophene-3-sulfonyl chloride
CID 112676712
5-methyl-N-(3-methylsulfinylbutyl)-4-sulfamoylthiophene-2-carboxamide
CID 115729501
N-[(1-cyclopropylcyclopropyl)methyl]-5-methyl-4-sulfamoylthiophene-2-carboxamide
CID 103839322
5-methyl-N-(oxan-4-ylmethyl)-4-sulfamoylthiophene-2-carboxamide
CID 115612472
5-methyl-N-[(2-methylcyclopentyl)methyl]-4-sulfamoylthiophene-2-carboxamide
CID 107421025
2-methoxyethyl 5-methyl-4-sulfamoylthiophene-2-carboxylate
CID 112689917
2-[(2-methylpropan-2-yl)oxy]ethyl 5-methyl-4-sulfamoylthiophene-2-carboxylate
CID 115615927
N-(2-cyclopentyloxyethyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide
CID 115612435
4-(tert-butylsulfamoyl)-N-ethyl-5-methylthiophene-2-carboxamide
CID 6502980
N,5-dimethyl-N-(2-methylpropyl)-4-sulfamoylthiophene-2-carboxamide
CID 112689674

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide?
The IUPAC name of N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide (CID 112689693) is N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide is Cc1sc(C(=O)NCC(C)(C)C)cc1S(N)(=O)=O.
What is the InChIKey of N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide?
The InChIKey is GDKQPMRWXHXOSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S2/c1-7-9(18(12,15)16)5-8(17-7)10(14)13-6-11(2,3)4/h5H,6H2,1-4H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide?
N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide is sourced from PubChem (CID 112689693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).