N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide

C21H18N2O2 — CID 5420157

IUPACN-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)N/N=C\c1ccccc1
InChIInChI=1S/C21H18N2O2/c24-21(23-22-15-17-9-3-1-4-10-17)16-25-20-14-8-7-13-19(20)18-11-5-2-6-12-18/h1-15H,16H2,(H,23,24)/b22-15-
InChIKeyROHUOGXYUISJQP-JCMHNJIXSA-N
MW330.39 g/mol
LogP3.88
Rot. Bonds6

About N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide

N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide (PubChem CID 5420157) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide
PubChem CID5420157
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC NameN-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide
SMILESO=C(COc1ccccc1-c1ccccc1)N/N=C\c1ccccc1
InChIInChI=1S/C21H18N2O2/c24-21(23-22-15-17-9-3-1-4-10-17)16-25-20-14-8-7-13-19(20)18-11-5-2-6-12-18/h1-15H,16H2,(H,23,24)/b22-15-
InChIKeyROHUOGXYUISJQP-JCMHNJIXSA-N
XLogP3.88
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.88
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

N-[(4-hydroxyphenyl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 922567
N-[(E)-(4-hydroxyphenyl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 135603269
2-(2-phenylphenoxy)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 7744227
2-[2-[[[2-(2-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenoxy]acetic acid
CID 1244956
N-(benzylideneamino)-2-(2-hydroxyphenoxy)acetamide
CID 2308885
2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
CID 922521
N-(benzylideneamino)-2-(2-ethoxyphenoxy)acetamide
CID 724075
N-[(Z)-(5-methylthiophen-2-yl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 6123716
2-(2-phenylphenoxy)-N-[(Z)-(2,4,5-trimethoxyphenyl)methylideneamino]acetamide
CID 9315527
N-[(E)-benzylideneamino]-2-[2-(1,2-oxazol-5-yl)phenoxy]acetamide
CID 44722987
N-[(Z)-(1-benzylpyrazol-4-yl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 8979040
N-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 135610830

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide (CID 5420157) is N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide is O=C(COc1ccccc1-c1ccccc1)N/N=C\c1ccccc1.
What is the InChIKey of N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide?
The InChIKey is ROHUOGXYUISJQP-JCMHNJIXSA-N. The full InChI is InChI=1S/C21H18N2O2/c24-21(23-22-15-17-9-3-1-4-10-17)16-25-20-14-8-7-13-19(20)18-11-5-2-6-12-18/h1-15H,16H2,(H,23,24)/b22-15-.
What are the key properties of N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide?
N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide has a molecular weight of 330.39 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 5420157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).