N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide

C12H11N3O2S2 — CID 7092416

IUPACN-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide
SMILESO=C(CNC(=O)c1cccs1)N/N=C\c1cccs1
InChIInChI=1S/C12H11N3O2S2/c16-11(15-14-7-9-3-1-5-18-9)8-13-12(17)10-4-2-6-19-10/h1-7H,8H2,(H,13,17)(H,15,16)/b14-7-
InChIKeyQFPMPDDKCYNSOQ-AUWJEWJLSA-N
MW293.37 g/mol
LogP1.69
Rot. Bonds5

About N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide

N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide (PubChem CID 7092416) has the molecular formula C12H11N3O2S2 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide
PubChem CID7092416
Molecular FormulaC12H11N3O2S2
Molecular Weight293.37 g/mol
Exact Mass293.03
IUPAC NameN-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide
SMILESO=C(CNC(=O)c1cccs1)N/N=C\c1cccs1
InChIInChI=1S/C12H11N3O2S2/c16-11(15-14-7-9-3-1-5-18-9)8-13-12(17)10-4-2-6-19-10/h1-7H,8H2,(H,13,17)(H,15,16)/b14-7-
InChIKeyQFPMPDDKCYNSOQ-AUWJEWJLSA-N
XLogP1.69
TPSA70.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide (CID 7092416) is N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide is O=C(CNC(=O)c1cccs1)N/N=C\c1cccs1.
What is the InChIKey of N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide?
The InChIKey is QFPMPDDKCYNSOQ-AUWJEWJLSA-N. The full InChI is InChI=1S/C12H11N3O2S2/c16-11(15-14-7-9-3-1-5-18-9)8-13-12(17)10-4-2-6-19-10/h1-7H,8H2,(H,13,17)(H,15,16)/b14-7-.
What are the key properties of N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide?
N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.69, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[(2Z)-2-(thiophen-2-ylmethylidene)hydrazinyl]ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 7092416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).