N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide

C10H17N3O3S2 — CID 119630138

IUPACN-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide
SMILESCNS(=O)(=O)c1csc(C(=O)NCC(C)(C)N)c1
InChIInChI=1S/C10H17N3O3S2/c1-10(2,11)6-13-9(14)8-4-7(5-17-8)18(15,16)12-3/h4-5,12H,6,11H2,1-3H3,(H,13,14)
InChIKeyVPHSEXDPRMBSEJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP0.12
Rot. Bonds5

About N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide

N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide (PubChem CID 119630138) has the molecular formula C10H17N3O3S2 and a molecular weight of 291.40 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide
PubChem CID119630138
Molecular FormulaC10H17N3O3S2
Molecular Weight291.40 g/mol
Exact Mass291.07
IUPAC NameN-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide
SMILESCNS(=O)(=O)c1csc(C(=O)NCC(C)(C)N)c1
InChIInChI=1S/C10H17N3O3S2/c1-10(2,11)6-13-9(14)8-4-7(5-17-8)18(15,16)12-3/h4-5,12H,6,11H2,1-3H3,(H,13,14)
InChIKeyVPHSEXDPRMBSEJ-UHFFFAOYSA-N
XLogP0.12
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide (CID 119630138) is N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide is CNS(=O)(=O)c1csc(C(=O)NCC(C)(C)N)c1.
What is the InChIKey of N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide?
The InChIKey is VPHSEXDPRMBSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3S2/c1-10(2,11)6-13-9(14)8-4-7(5-17-8)18(15,16)12-3/h4-5,12H,6,11H2,1-3H3,(H,13,14).
What are the key properties of N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide?
N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 0.12, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)-4-(methylsulfamoyl)thiophene-2-carboxamide is sourced from PubChem (CID 119630138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).