(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine

C16H17NO2 — CID 21473328

IUPAC(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine
SMILESCO/N=C(\Cc1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C16H17NO2/c1-18-15-10-8-14(9-11-15)16(17-19-2)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3/b17-16+
InChIKeyYUPCCDIPPINZRA-WUKNDPDISA-N
MW255.32 g/mol
LogP3.29
Rot. Bonds5

About (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine

(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine (PubChem CID 21473328) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine.

Molecular Properties

Compound Name(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine
PubChem CID21473328
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine
SMILESCO/N=C(\Cc1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C16H17NO2/c1-18-15-10-8-14(9-11-15)16(17-19-2)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3/b17-16+
InChIKeyYUPCCDIPPINZRA-WUKNDPDISA-N
XLogP3.29
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.29
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

(NE)-N-[1-(4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 10060245
(NE)-N-[1,2-bis(4-methoxyphenyl)ethylidene]hydroxylamine
CID 5402606
2-bromo-N-[[1-(4-methoxyphenyl)-2-phenylethylidene]amino]aniline
CID 59107128
(E)-N-methoxy-1-(4-methoxyphenyl)pent-4-en-1-imine
CID 46944422
(E)-N-phenoxy-1,2-diphenylethanimine
CID 102323138
(Z)-N,N'-dimethoxy-1,4-diphenylbutane-1,4-diimine
CID 87328023
N-methoxy-2-(4-methoxyphenyl)-1-(2,3,4-trimethoxyphenyl)ethanimine
CID 57400546
1-(3-methoxyphenyl)-N-methyl-2-phenylethanimine
CID 130450692
N-methoxy-2-phenylethanimidoyl bromide
CID 165358038
(Z)-N-methoxy-2-[4-(phenoxymethyl)phenoxy]-1-phenylethanimine
CID 141330759
bromomethylbenzene;1-(bromomethyl)-4-methoxybenzene
CID 70390972
N-methoxy-1-(4-methoxyphenyl)-2-(4-methylphenyl)sulfanylethanimine
CID 1471539

Frequently Asked Questions

What is the IUPAC name of (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine?
The IUPAC name of (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine (CID 21473328) is (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine.
What is the SMILES notation for (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine?
The canonical SMILES for (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine is CO/N=C(\Cc1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine?
The InChIKey is YUPCCDIPPINZRA-WUKNDPDISA-N. The full InChI is InChI=1S/C16H17NO2/c1-18-15-10-8-14(9-11-15)16(17-19-2)12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3/b17-16+.
What are the key properties of (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine?
(E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine has a molecular weight of 255.32 g/mol, XLogP of 3.29, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-methoxy-1-(4-methoxyphenyl)-2-phenylethanimine is sourced from PubChem (CID 21473328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).