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

C20H24N2O2 — CID 9315533

IUPACN-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide
SMILESCCC(/C=N\NC(=O)COc1ccccc1-c1ccccc1)CC
InChIInChI=1S/C20H24N2O2/c1-3-16(4-2)14-21-22-20(23)15-24-19-13-9-8-12-18(19)17-10-6-5-7-11-17/h5-14,16H,3-4,15H2,1-2H3,(H,22,23)/b21-14-
InChIKeyPXNZPSZNENQMFR-STZFKDTASA-N
MW324.42 g/mol
LogP4.27
Rot. Bonds8

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

N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide (PubChem CID 9315533) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide
PubChem CID9315533
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide
SMILESCCC(/C=N\NC(=O)COc1ccccc1-c1ccccc1)CC
InChIInChI=1S/C20H24N2O2/c1-3-16(4-2)14-21-22-20(23)15-24-19-13-9-8-12-18(19)17-10-6-5-7-11-17/h5-14,16H,3-4,15H2,1-2H3,(H,22,23)/b21-14-
InChIKeyPXNZPSZNENQMFR-STZFKDTASA-N
XLogP4.27
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.27
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-[(Z)-benzylideneamino]-2-(2-phenylphenoxy)acetamide
CID 5420157
2-(2-phenylphenoxy)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
CID 7744227
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
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
2-(2-phenylphenoxy)-N-(thiophen-2-ylmethylideneamino)acetamide
CID 922521
N-[(E)-(4-bromothiophen-2-yl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 42995414
N-[(9-ethylcarbazol-3-yl)methylideneamino]-2-(2-phenylphenoxy)acetamide
CID 3506862
2-(2-phenylphenoxy)-N-propylacetamide
CID 112788813
N'-acetyl-2-(2-phenylphenoxy)acetohydrazide
CID 922584

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide?
The IUPAC name of N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide (CID 9315533) is N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide.
What is the SMILES notation for N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide?
The canonical SMILES for N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide is CCC(/C=N\NC(=O)COc1ccccc1-c1ccccc1)CC.
What is the InChIKey of N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide?
The InChIKey is PXNZPSZNENQMFR-STZFKDTASA-N. The full InChI is InChI=1S/C20H24N2O2/c1-3-16(4-2)14-21-22-20(23)15-24-19-13-9-8-12-18(19)17-10-6-5-7-11-17/h5-14,16H,3-4,15H2,1-2H3,(H,22,23)/b21-14-.
What are the key properties of N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide?
N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide has a molecular weight of 324.42 g/mol, XLogP of 4.27, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-ethylbutylideneamino]-2-(2-phenylphenoxy)acetamide is sourced from PubChem (CID 9315533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).