5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide

C6H10N4O4S2 — CID 83023425

IUPAC5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide
SMILESCN(C)NS(=O)(=O)c1cc([N+](=O)[O-])c(N)s1
InChIInChI=1S/C6H10N4O4S2/c1-9(2)8-16(13,14)5-3-4(10(11)12)6(7)15-5/h3,8H,7H2,1-2H3
InChIKeyGAQIXLLJEXTKEN-UHFFFAOYSA-N
MW266.30 g/mol
LogP-0.01
Rot. Bonds4

About 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide

5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide (PubChem CID 83023425) has the molecular formula C6H10N4O4S2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide.

Molecular Properties

Compound Name5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide
PubChem CID83023425
Molecular FormulaC6H10N4O4S2
Molecular Weight266.30 g/mol
Exact Mass266.01
IUPAC Name5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide
SMILESCN(C)NS(=O)(=O)c1cc([N+](=O)[O-])c(N)s1
InChIInChI=1S/C6H10N4O4S2/c1-9(2)8-16(13,14)5-3-4(10(11)12)6(7)15-5/h3,8H,7H2,1-2H3
InChIKeyGAQIXLLJEXTKEN-UHFFFAOYSA-N
XLogP-0.01
TPSA118.57 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-[2-(dimethylamino)ethyl]-4-nitrothiophene-2-sulfonamide
CID 80746787
5-amino-N-ethyl-4-nitrothiophene-2-sulfonamide
CID 80747001
5-amino-N-[2-[methyl(propan-2-yl)amino]ethyl]-4-nitrothiophene-2-sulfonamide
CID 80747419
5-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-nitrothiophene-2-sulfonamide
CID 114389272
5-amino-N-(5-methyl-1,2-oxazol-3-yl)-4-nitrothiophene-2-sulfonamide
CID 80746501
5-amino-N-[2-(diethylamino)ethyl]-4-nitrothiophene-2-sulfonamide
CID 80746263
5-amino-N-(3,5-difluorophenyl)-4-nitrothiophene-2-sulfonamide
CID 80744953
5-amino-N-(3-fluoro-5-methylphenyl)-4-nitrothiophene-2-sulfonamide
CID 80727272
5-amino-4-nitro-N-(1,2-oxazol-3-yl)thiophene-2-sulfonamide
CID 80746819
5-amino-N-(2-methoxypropyl)-4-nitrothiophene-2-sulfonamide
CID 102700474
5-amino-N-[(3-methylthiophen-2-yl)methyl]-4-nitrothiophene-2-sulfonamide
CID 80747034
5-amino-N-(5-bromopyrazin-2-yl)-4-nitrothiophene-2-sulfonamide
CID 80747323

Frequently Asked Questions

What is the IUPAC name of 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide?
The IUPAC name of 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide (CID 83023425) is 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide.
What is the SMILES notation for 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide?
The canonical SMILES for 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide is CN(C)NS(=O)(=O)c1cc([N+](=O)[O-])c(N)s1.
What is the InChIKey of 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide?
The InChIKey is GAQIXLLJEXTKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O4S2/c1-9(2)8-16(13,14)5-3-4(10(11)12)6(7)15-5/h3,8H,7H2,1-2H3.
What are the key properties of 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide?
5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide has a molecular weight of 266.30 g/mol, XLogP of -0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N',N'-dimethyl-4-nitrothiophene-2-sulfonohydrazide is sourced from PubChem (CID 83023425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).