1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine

C16H17NO — CID 126208870

IUPAC1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine
SMILESCCOc1cccc(/C=N/c2ccccc2C)c1
InChIInChI=1S/C16H17NO/c1-3-18-15-9-6-8-14(11-15)12-17-16-10-5-4-7-13(16)2/h4-12H,3H2,1-2H3/b17-12+
InChIKeySNCJBLWHZBLCHG-SFQUDFHCSA-N
MW239.32 g/mol
LogP4.14
Rot. Bonds4

About 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine

1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine (PubChem CID 126208870) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine.

Molecular Properties

Compound Name1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine
PubChem CID126208870
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine
SMILESCCOc1cccc(/C=N/c2ccccc2C)c1
InChIInChI=1S/C16H17NO/c1-3-18-15-9-6-8-14(11-15)12-17-16-10-5-4-7-13(16)2/h4-12H,3H2,1-2H3/b17-12+
InChIKeySNCJBLWHZBLCHG-SFQUDFHCSA-N
XLogP4.14
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-[3-[(2-chlorophenyl)methoxy]phenyl]-N-(2-methylphenyl)methanimine
CID 126209712
1-(3-ethoxyphenyl)-N-(3-phenoxyphenyl)methanimine
CID 10881658
4-[[3-[(2-methylphenyl)iminomethyl]phenoxy]methyl]benzoic acid
CID 126207463
1-(3-ethoxyphenyl)-N-(4-phenoxyphenyl)methanimine
CID 126205554
1-(3-ethoxyphenyl)-N-(4-methoxyphenyl)methanimine
CID 126205496
1-(3-ethoxyphenyl)-N-(4-ethylphenyl)methanimine
CID 126216277
N-butyl-1-(3-ethoxyphenyl)methanimine
CID 584358
1-(3-methoxyphenyl)-N-[2-[(3-methoxyphenyl)methylideneamino]phenyl]methanimine
CID 932000
N-[(3-ethoxyphenyl)methylideneamino]aniline
CID 169381619
2-ethoxy-4-[(2-methylphenyl)iminomethyl]-6-prop-2-enylphenol
CID 137162256
N'-[(Z)-(3-ethoxyphenyl)methylideneamino]-N-(2-methylphenyl)oxamide
CID 8932252
N-(5-chloro-2-methylphenyl)-1-[3-[(2-fluorophenyl)methoxy]phenyl]methanimine
CID 126219727

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine?
The IUPAC name of 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine (CID 126208870) is 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine.
What is the SMILES notation for 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine?
The canonical SMILES for 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine is CCOc1cccc(/C=N/c2ccccc2C)c1.
What is the InChIKey of 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine?
The InChIKey is SNCJBLWHZBLCHG-SFQUDFHCSA-N. The full InChI is InChI=1S/C16H17NO/c1-3-18-15-9-6-8-14(11-15)12-17-16-10-5-4-7-13(16)2/h4-12H,3H2,1-2H3/b17-12+.
What are the key properties of 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine?
1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine has a molecular weight of 239.32 g/mol, XLogP of 4.14, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxyphenyl)-N-(2-methylphenyl)methanimine is sourced from PubChem (CID 126208870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).