2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide

C20H18N2OS — CID 969030

IUPAC2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide
SMILESCC(=NNC(=O)C(c1ccccc1)c1ccccc1)c1cccs1
InChIInChI=1S/C20H18N2OS/c1-15(18-13-8-14-24-18)21-22-20(23)19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,19H,1H3,(H,22,23)
InChIKeyPIWFXUSXWDICKL-UHFFFAOYSA-N
MW334.44 g/mol
LogP4.42
Rot. Bonds5

About 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide

2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide (PubChem CID 969030) has the molecular formula C20H18N2OS and a molecular weight of 334.44 g/mol. Its IUPAC name is 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide.

Molecular Properties

Compound Name2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide
PubChem CID969030
Molecular FormulaC20H18N2OS
Molecular Weight334.44 g/mol
Exact Mass334.11
IUPAC Name2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide
SMILESCC(=NNC(=O)C(c1ccccc1)c1ccccc1)c1cccs1
InChIInChI=1S/C20H18N2OS/c1-15(18-13-8-14-24-18)21-22-20(23)19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,19H,1H3,(H,22,23)
InChIKeyPIWFXUSXWDICKL-UHFFFAOYSA-N
XLogP4.42
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.44
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

2-phenyl-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide
CID 6116253
N-[1-(4-fluorophenyl)ethylideneamino]-2,2-diphenylacetamide
CID 827608
3-phenylsulfanyl-N-(1-thiophen-2-ylethylideneamino)propanamide
CID 3828723
2-methyl-N-[(E)-1-thiophen-2-ylethylideneamino]benzamide
CID 5428052
2-chloro-N-[(E)-1-thiophen-2-ylethylideneamino]benzamide
CID 5333978
2-(5-oxo-1,2-dihydropyrazol-3-yl)-N-[(Z)-1-thiophen-2-ylethylideneamino]acetamide
CID 6338643
N,N'-bis[(E)-1-thiophen-2-ylethylideneamino]heptanediamide
CID 19685885
N-[(Z)-1-thiophen-2-ylethylideneamino]cyclopropanecarboxamide
CID 6340204
N-[(Z)-1-naphthalen-1-ylethylideneamino]-2,2-diphenylacetamide
CID 126396854
2-anilino-N-(1-thiophen-2-ylethylideneamino)benzamide
CID 5090031
2-phenyl-N-[(Z)-1-thiophen-2-ylethylideneamino]cyclopropane-1-carboxamide
CID 6370476
4-(phenylsulfanylmethyl)-N-[(Z)-1-thiophen-2-ylethylideneamino]benzamide
CID 95180952

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide?
The IUPAC name of 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide (CID 969030) is 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide.
What is the SMILES notation for 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide?
The canonical SMILES for 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide is CC(=NNC(=O)C(c1ccccc1)c1ccccc1)c1cccs1.
What is the InChIKey of 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide?
The InChIKey is PIWFXUSXWDICKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2OS/c1-15(18-13-8-14-24-18)21-22-20(23)19(16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2-14,19H,1H3,(H,22,23).
What are the key properties of 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide?
2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide has a molecular weight of 334.44 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-(1-thiophen-2-ylethylideneamino)acetamide is sourced from PubChem (CID 969030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).