3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide

C14H11N3O2S2 — CID 1481207

IUPAC3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)c1sccc1-n1cccc1)c1cccs1
InChIInChI=1S/C14H11N3O2S2/c18-13(11-4-3-8-20-11)15-16-14(19)12-10(5-9-21-12)17-6-1-2-7-17/h1-9H,(H,15,18)(H,16,19)
InChIKeyFUNWZWUDXMTSRA-UHFFFAOYSA-N
MW317.40 g/mol
LogP2.68
Rot. Bonds3

About 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide

3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide (PubChem CID 1481207) has the molecular formula C14H11N3O2S2 and a molecular weight of 317.40 g/mol. Its IUPAC name is 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide.

Molecular Properties

Compound Name3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide
PubChem CID1481207
Molecular FormulaC14H11N3O2S2
Molecular Weight317.40 g/mol
Exact Mass317.03
IUPAC Name3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide
SMILESO=C(NNC(=O)c1sccc1-n1cccc1)c1cccs1
InChIInChI=1S/C14H11N3O2S2/c18-13(11-4-3-8-20-11)15-16-14(19)12-10(5-9-21-12)17-6-1-2-7-17/h1-9H,(H,15,18)(H,16,19)
InChIKeyFUNWZWUDXMTSRA-UHFFFAOYSA-N
XLogP2.68
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.40
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-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

N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]thiophene-2-carboxamide
CID 6880392
N'-(2-thienylcarbonyl)nicotinohydrazide
CID 686151
4-(isopropylsulfonyl)-3-(1H-pyrrol-1-yl)-2-thiophenecarbohydrazide
CID 2819591
3-(1H-Pyrrol-1-yl)-2-thiophenecarboxylic acid 2-(4-fluorobenzoyl)hydrazide
CID 3811376
1-[2-(pyrrolidin-1-ylcarbonyl)thien-3-yl]-1H-pyrrole
CID 3245590
N'-benzoyl-3-(1H-pyrrol-1-yl)-2-thiophenecarbohydrazide
CID 3811213
N'-[(Z)-phenylmethylidene]-3-(1H-pyrrol-1-yl)-2-thiophenecarbohydrazide
CID 5524513
N'-[(Z)-(3-methylphenyl)methylidene]-3-(1H-pyrrol-1-yl)-2-thiophenecarbohydrazide
CID 5524529
N'-(2,6-difluorobenzoyl)-3-(1H-pyrrol-1-yl)-2-thiophenecarbohydrazide
CID 1481215
N-[(5Z)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]pyridine-3-carboxamide
CID 2045736
N-phenyl-2-{[3-(1H-pyrrol-1-yl)-2-thienyl]carbonyl}-1-hydrazinecarboxamide
CID 3798867
3-(1H-pyrrol-1-yl)-N'-[(Z)-2-thienylmethylidene]-2-thiophenecarbohydrazide
CID 5524528

Frequently Asked Questions

What is the IUPAC name of 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
The IUPAC name of 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide (CID 1481207) is 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide.
What is the SMILES notation for 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
The canonical SMILES for 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide is O=C(NNC(=O)c1sccc1-n1cccc1)c1cccs1.
What is the InChIKey of 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
The InChIKey is FUNWZWUDXMTSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2S2/c18-13(11-4-3-8-20-11)15-16-14(19)12-10(5-9-21-12)17-6-1-2-7-17/h1-9H,(H,15,18)(H,16,19).
What are the key properties of 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide?
3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide has a molecular weight of 317.40 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrol-1-yl-N'-(thiophene-2-carbonyl)thiophene-2-carbohydrazide is sourced from PubChem (CID 1481207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).