2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide

C19H16N2O2S — CID 922521

IUPAC2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)NN=Cc1cccs1
InChIInChI=1S/C19H16N2O2S/c22-19(21-20-13-16-9-6-12-24-16)14-23-18-11-5-4-10-17(18)15-7-2-1-3-8-15/h1-13H,14H2,(H,21,22)
InChIKeyZJDJBUNPENSGOS-UHFFFAOYSA-N
MW336.42 g/mol
LogP3.94
Rot. Bonds6

About 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide

2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide (PubChem CID 922521) has the molecular formula C19H16N2O2S and a molecular weight of 336.42 g/mol. Its IUPAC name is 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide.

Molecular Properties

Compound Name2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
PubChem CID922521
Molecular FormulaC19H16N2O2S
Molecular Weight336.42 g/mol
Exact Mass336.09
IUPAC Name2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)NN=Cc1cccs1
InChIInChI=1S/C19H16N2O2S/c22-19(21-20-13-16-9-6-12-24-16)14-23-18-11-5-4-10-17(18)15-7-2-1-3-8-15/h1-13H,14H2,(H,21,22)
InChIKeyZJDJBUNPENSGOS-UHFFFAOYSA-N
XLogP3.94
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 53.94
H-Bond Donors ≤ 51
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

2-(2-ethoxyphenoxy)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide
CID 25249395
2-(2-fluorophenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
CID 3895307
N-[(E)-(4-bromothiophen-2-yl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 42995414
N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide
CID 5420157
N-[(Z)-(5-methylthiophen-2-yl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 6123716
N-[(4-hydroxyphenyl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 922567
N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 135603269
2-[2-[[[2-(2-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenoxy]acetic acid
CID 1244956
2-(2-phenylphenoxy)-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide
CID 9315527
2-(2-phenylphenoxy)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 7744227
N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide
CID 9315533
N'-[2-(2-phenylphenoxy)acetyl]-2-thiophen-2-ylacetohydrazide
CID 7978348

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide?
The IUPAC name of 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide (CID 922521) is 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide.
What is the SMILES notation for 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide?
The canonical SMILES for 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide is O=C(COc1ccccc1-c1ccccc1)NN=Cc1cccs1.
What is the InChIKey of 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide?
The InChIKey is ZJDJBUNPENSGOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2S/c22-19(21-20-13-16-9-6-12-24-16)14-23-18-11-5-4-10-17(18)15-7-2-1-3-8-15/h1-13H,14H2,(H,21,22).
What are the key properties of 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide?
2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide has a molecular weight of 336.42 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide is sourced from PubChem (CID 922521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).