1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine

C17H19NO2 — CID 141463783

IUPAC1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine
SMILESCCOc1ccc(C(C)=NOCc2ccccc2)cc1
InChIInChI=1S/C17H19NO2/c1-3-19-17-11-9-16(10-12-17)14(2)18-20-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3
InChIKeyLBQDMHWTGODORW-UHFFFAOYSA-N
MW269.34 g/mol
LogP4.03
Rot. Bonds6

About 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine

1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine (PubChem CID 141463783) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine
PubChem CID141463783
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine
SMILESCCOc1ccc(C(C)=NOCc2ccccc2)cc1
InChIInChI=1S/C17H19NO2/c1-3-19-17-11-9-16(10-12-17)14(2)18-20-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3
InChIKeyLBQDMHWTGODORW-UHFFFAOYSA-N
XLogP4.03
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 54.03
H-Bond Donors ≤ 50
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

(E)-1-(4-bromophenyl)-N-phenylmethoxyethanimine
CID 71724198
4-[(E)-C-methyl-N-phenylmethoxycarbonimidoyl]benzonitrile
CID 46566994
(E)-N-phenoxy-1-(4-phenylmethoxyphenyl)ethanimine
CID 177429054
methyl 4-[[(E)-1-(4-phenacyloxyphenyl)ethylideneamino]oxymethyl]benzoate
CID 86292404
N-[(Z)-1-(4-ethoxyphenyl)ethylideneamino]-2-phenylacetamide
CID 5399435
ethene;1-ethoxy-4-phenylmethoxybenzene
CID 174705965
(NZ)-N-[1-(4-ethoxyphenyl)ethylidene]hydroxylamine
CID 6161397
N'-amino-2-[[5-[(E)-N-[(4-ethoxyphenyl)methoxy]-C-methylcarbonimidoyl]-2-pyridinyl]oxy]ethanimidamide
CID 134388914
1-(4-ethoxyphenyl)ethylidenehydrazine
CID 937394
(E)-N-phenylmethoxy-1-[4-(1,2,4-triazol-1-yl)phenyl]ethanimine
CID 42935131
3-(C-methyl-N-phenylmethoxycarbonimidoyl)benzonitrile
CID 73433324
2-methyl-5-[(E)-C-methyl-N-phenylmethoxycarbonimidoyl]benzonitrile
CID 18388799

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine?
The IUPAC name of 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine (CID 141463783) is 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine.
What is the SMILES notation for 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine?
The canonical SMILES for 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine is CCOc1ccc(C(C)=NOCc2ccccc2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine?
The InChIKey is LBQDMHWTGODORW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-3-19-17-11-9-16(10-12-17)14(2)18-20-13-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine?
1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine has a molecular weight of 269.34 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)-N-phenylmethoxyethanimine is sourced from PubChem (CID 141463783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).