N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide

C22H20N4O2 — CID 6881889

IUPACN-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide
SMILESO=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cccnc1
InChIInChI=1S/C22H20N4O2/c27-20(26-25-15-17-8-7-13-23-14-17)16-24-22(28)21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-15,21H,16H2,(H,24,28)(H,26,27)/b25-15+
InChIKeyRIABCKZFFZHIHH-MFKUBSTISA-N
MW372.43 g/mol
LogP2.48
Rot. Bonds7

About N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide

N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide (PubChem CID 6881889) has the molecular formula C22H20N4O2 and a molecular weight of 372.43 g/mol. Its IUPAC name is N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide
PubChem CID6881889
Molecular FormulaC22H20N4O2
Molecular Weight372.43 g/mol
Exact Mass372.16
IUPAC NameN-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide
SMILESO=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cccnc1
InChIInChI=1S/C22H20N4O2/c27-20(26-25-15-17-8-7-13-23-14-17)16-24-22(28)21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-15,21H,16H2,(H,24,28)(H,26,27)/b25-15+
InChIKeyRIABCKZFFZHIHH-MFKUBSTISA-N
XLogP2.48
TPSA83.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.43
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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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Related Compounds

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CID 4047159

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide?
The IUPAC name of N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide (CID 6881889) is N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide is O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1cccnc1.
What is the InChIKey of N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide?
The InChIKey is RIABCKZFFZHIHH-MFKUBSTISA-N. The full InChI is InChI=1S/C22H20N4O2/c27-20(26-25-15-17-8-7-13-23-14-17)16-24-22(28)21(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-15,21H,16H2,(H,24,28)(H,26,27)/b25-15+.
What are the key properties of N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide?
N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide has a molecular weight of 372.43 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[(2E)-2-(pyridin-3-ylmethylidene)hydrazinyl]ethyl]-2,2-diphenylacetamide is sourced from PubChem (CID 6881889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).