1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine

C20H22N2 — CID 70190165

IUPAC1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine
SMILESC/C=C/CCc1ccc(C=NN=Cc2ccc(C)cc2)cc1
InChIInChI=1S/C20H22N2/c1-3-4-5-6-18-11-13-20(14-12-18)16-22-21-15-19-9-7-17(2)8-10-19/h3-4,7-16H,5-6H2,1-2H3/b4-3+,21-15?,22-16?
InChIKeyGRPJFXMXDOZGDT-RRRWRSCXSA-N
MW290.41 g/mol
LogP4.96
Rot. Bonds6

About 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine

1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine (PubChem CID 70190165) has the molecular formula C20H22N2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine.

Molecular Properties

Compound Name1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine
PubChem CID70190165
Molecular FormulaC20H22N2
Molecular Weight290.41 g/mol
Exact Mass290.18
IUPAC Name1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine
SMILESC/C=C/CCc1ccc(C=NN=Cc2ccc(C)cc2)cc1
InChIInChI=1S/C20H22N2/c1-3-4-5-6-18-11-13-20(14-12-18)16-22-21-15-19-9-7-17(2)8-10-19/h3-4,7-16H,5-6H2,1-2H3/b4-3+,21-15?,22-16?
InChIKeyGRPJFXMXDOZGDT-RRRWRSCXSA-N
XLogP4.96
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

N-[(4-pent-3-enylphenyl)methylideneamino]-1-(4-propylphenyl)methanimine
CID 54210930
(E)-1-(4-heptylphenyl)-N-[(E)-[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine
CID 19368303
1-pent-3-enyl-4-(4-pent-3-enylphenyl)benzene
CID 76695097
(E)-N-[(E)-(4-hexylphenyl)methylideneamino]-1-(4-methylphenyl)methanimine
CID 20845118
N-[(4-ethoxy-2,3-difluorophenyl)methylideneamino]-1-[4-[(E)-pent-3-enyl]phenyl]methanimine
CID 70289635
N-[(4-chlorophenyl)methylideneamino]-1-(4-hex-3-enylphenyl)methanimine
CID 54560984
(E)-1-(4-methylphenyl)-N-[(E)-(4-prop-2-enylphenyl)methylideneamino]methanimine
CID 19368603
1-pent-3-enyl-4-propylbenzene
CID 72599491
N-[[4-[(E)-hex-3-enyl]phenyl]methylideneamino]-1-(4-pentylphenyl)methanimine
CID 70190206
4-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]benzonitrile
CID 139780621
1-[(E)-pent-3-enyl]-4-[2-[4-[(E)-4-[4-[(E)-pent-3-enyl]phenyl]but-2-enyl]phenyl]ethyl]benzene
CID 140774698
1-hept-3-enyl-4-pent-3-enylbenzene
CID 123755117

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine?
The IUPAC name of 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine (CID 70190165) is 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine.
What is the SMILES notation for 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine?
The canonical SMILES for 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine is C/C=C/CCc1ccc(C=NN=Cc2ccc(C)cc2)cc1.
What is the InChIKey of 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine?
The InChIKey is GRPJFXMXDOZGDT-RRRWRSCXSA-N. The full InChI is InChI=1S/C20H22N2/c1-3-4-5-6-18-11-13-20(14-12-18)16-22-21-15-19-9-7-17(2)8-10-19/h3-4,7-16H,5-6H2,1-2H3/b4-3+,21-15?,22-16?.
What are the key properties of 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine?
1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine has a molecular weight of 290.41 g/mol, XLogP of 4.96, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-N-[[4-[(E)-pent-3-enyl]phenyl]methylideneamino]methanimine is sourced from PubChem (CID 70190165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).