3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide

C9H13N3O4S2 — CID 16646041

IUPAC3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide
SMILESNNC(=O)c1sccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C9H13N3O4S2/c10-11-9(13)8-7(1-6-17-8)18(14,15)12-2-4-16-5-3-12/h1,6H,2-5,10H2,(H,11,13)
InChIKeyZHEYGDXAZVAGQN-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.63
Rot. Bonds3

About 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide

3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide (PubChem CID 16646041) has the molecular formula C9H13N3O4S2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide.

Molecular Properties

Compound Name3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide
PubChem CID16646041
Molecular FormulaC9H13N3O4S2
Molecular Weight291.35 g/mol
Exact Mass291.03
IUPAC Name3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide
SMILESNNC(=O)c1sccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C9H13N3O4S2/c10-11-9(13)8-7(1-6-17-8)18(14,15)12-2-4-16-5-3-12/h1,6H,2-5,10H2,(H,11,13)
InChIKeyZHEYGDXAZVAGQN-UHFFFAOYSA-N
XLogP-0.63
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide 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

3-morpholin-4-ylsulfonyl-N-prop-2-enylthiophene-2-carboxamide
CID 25391714
2,2-dimethyl-3-[(3-morpholin-4-ylsulfonylthiophene-2-carbonyl)amino]propanoic acid
CID 119249833
3-[(3-morpholin-4-ylsulfonylthiophene-2-carbonyl)amino]butanoic acid
CID 119221163
N-(1-adamantylmethyl)-3-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 38075450
3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide
CID 119386595
N-[(4-hydroxypyrrolidin-3-yl)methyl]-3-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 120945933
N-(8-azabicyclo[3.2.1]octan-3-yl)-3-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 119455908
3-morpholin-4-ylsulfonyl-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]thiophene-2-carboxamide
CID 22108462
N-[1-(4-bromophenyl)ethyl]-3-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 55456444
3-[(3R)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carbohydrazide
CID 26585376
3-[(3S)-3-methylpiperidin-1-yl]sulfonylthiophene-2-carbohydrazide
CID 26585377
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-morpholin-4-ylsulfonylthiophene-2-carboxamide
CID 55510466

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide?
The IUPAC name of 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide (CID 16646041) is 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide.
What is the SMILES notation for 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide?
The canonical SMILES for 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide is NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide?
The InChIKey is ZHEYGDXAZVAGQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O4S2/c10-11-9(13)8-7(1-6-17-8)18(14,15)12-2-4-16-5-3-12/h1,6H,2-5,10H2,(H,11,13).
What are the key properties of 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide?
3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide has a molecular weight of 291.35 g/mol, XLogP of -0.63, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylsulfonylthiophene-2-carbohydrazide is sourced from PubChem (CID 16646041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).