N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine

C18H18N2O — CID 54465845

IUPACN-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine
SMILESC=CCc1ccc(C=NN=Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C18H18N2O/c1-3-4-15-5-7-16(8-6-15)13-19-20-14-17-9-11-18(21-2)12-10-17/h3,5-14H,1,4H2,2H3
InChIKeyXEUFHLQSDYYVED-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.88
Rot. Bonds6

About N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine

N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine (PubChem CID 54465845) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine
PubChem CID54465845
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC NameN-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine
SMILESC=CCc1ccc(C=NN=Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C18H18N2O/c1-3-4-15-5-7-16(8-6-15)13-19-20-14-17-9-11-18(21-2)12-10-17/h3,5-14H,1,4H2,2H3
InChIKeyXEUFHLQSDYYVED-UHFFFAOYSA-N
XLogP3.88
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(E)-1-(4-methylphenyl)-N-[(E)-(4-prop-2-enylphenyl)methylideneamino]methanimine
CID 19368603
1-(4-methoxyphenyl)-N-prop-2-enylmethanimine
CID 11052170
2-methoxy-6-prop-2-enylnaphthalene
CID 55253268
1-methoxy-4-[4-(4-methoxyphenyl)but-2-enyl]benzene
CID 54485845
1-methoxy-4-[(E)-3-(4-methoxyphenyl)prop-1-enyl]benzene
CID 10800947
1-(4-butoxyphenyl)-N-(4-prop-2-enylphenyl)methanimine
CID 67895495
3-[4-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]phenoxy]propan-1-ol
CID 10870679
1-(4-methoxyphenyl)-N-methylmethanimine;propane
CID 142550008
(E)-N-[(E)-(2-fluoro-4-propylphenyl)methylideneamino]-1-(4-methoxyphenyl)methanimine
CID 19368935
1-(1-deuterioprop-2-enyl)-4-methoxybenzene
CID 131851779
N-ethyl-1-(4-methoxyphenyl)methanimine
CID 12927006
1,2-bis[(4-methoxyphenyl)methoxy]-4-prop-2-enylbenzene
CID 54397178

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine?
The IUPAC name of N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine (CID 54465845) is N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine.
What is the SMILES notation for N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine?
The canonical SMILES for N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine is C=CCc1ccc(C=NN=Cc2ccc(OC)cc2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine?
The InChIKey is XEUFHLQSDYYVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-3-4-15-5-7-16(8-6-15)13-19-20-14-17-9-11-18(21-2)12-10-17/h3,5-14H,1,4H2,2H3.
What are the key properties of N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine?
N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine has a molecular weight of 278.36 g/mol, XLogP of 3.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methylideneamino]-1-(4-prop-2-enylphenyl)methanimine is sourced from PubChem (CID 54465845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).