(2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine

C24H21NO — CID 134851984

IUPAC(2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine
SMILESCOc1ccc(/N=C(\C=C\C=C\c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H21NO/c1-26-23-18-16-22(17-19-23)25-24(21-13-6-3-7-14-21)15-9-8-12-20-10-4-2-5-11-20/h2-19H,1H3/b12-8+,15-9+,25-24+
InChIKeySIZMCCSRMLQGJN-KYNJCZABSA-N
MW339.44 g/mol
LogP6.09
Rot. Bonds6

About (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine

(2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine (PubChem CID 134851984) has the molecular formula C24H21NO and a molecular weight of 339.44 g/mol. Its IUPAC name is (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine.

Molecular Properties

Compound Name(2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine
PubChem CID134851984
Molecular FormulaC24H21NO
Molecular Weight339.44 g/mol
Exact Mass339.16
IUPAC Name(2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine
SMILESCOc1ccc(/N=C(\C=C\C=C\c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C24H21NO/c1-26-23-18-16-22(17-19-23)25-24(21-13-6-3-7-14-21)15-9-8-12-20-10-4-2-5-11-20/h2-19H,1H3/b12-8+,15-9+,25-24+
InChIKeySIZMCCSRMLQGJN-KYNJCZABSA-N
XLogP6.09
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.44
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[[(E)-3-(4-methoxyphenyl)-1-phenylprop-2-enylidene]amino]benzenesulfonamide
CID 10715538
1-methoxy-4-(4-phenylbuta-1,3-dienyl)benzene
CID 4560156
(2E,4E)-5-(4-methoxyphenyl)-1-phenylpenta-2,4-dien-1-one
CID 10539553
1,2-bis[(1E)-4-(4-methoxyphenyl)buta-1,3-dienyl]benzene
CID 53491376
(3E,5E)-6-(4-methoxyphenyl)hexa-1,3,5-trien-2-ol
CID 89171740
N-[(Z)-[(E)-3-(4-methoxyphenyl)-1-phenylprop-2-enylidene]amino]aniline
CID 45146558
(Z)-3-hydroxy-N'-(4-methoxyphenyl)-3-phenylprop-2-enimidamide
CID 135399881
3-(4-bromophenyl)sulfanyl-1-(4-methoxyphenyl)-N-phenylprop-2-en-1-imine
CID 91104973
[N-(4-methoxyphenyl)-C-phenylcarbonimidoyl]-[3-[N-(4-methoxyphenyl)-C-phenylcarbonimidoyl]azanidylpropyl]azanide
CID 101430985
methyl 2-(4-methoxyphenyl)imino-2-phenylacetate
CID 11659050
2-(4-methoxyphenyl)-5-phenylpenta-2,4-dienenitrile
CID 3317052
5-[[(E)-3-(4-methoxyphenyl)-1-phenylprop-2-enylidene]amino]-1,3,4-thiadiazole-2-sulfonamide
CID 40541247

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine?
The IUPAC name of (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine (CID 134851984) is (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine.
What is the SMILES notation for (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine?
The canonical SMILES for (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine is COc1ccc(/N=C(\C=C\C=C\c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine?
The InChIKey is SIZMCCSRMLQGJN-KYNJCZABSA-N. The full InChI is InChI=1S/C24H21NO/c1-26-23-18-16-22(17-19-23)25-24(21-13-6-3-7-14-21)15-9-8-12-20-10-4-2-5-11-20/h2-19H,1H3/b12-8+,15-9+,25-24+.
What are the key properties of (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine?
(2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine has a molecular weight of 339.44 g/mol, XLogP of 6.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-N-(4-methoxyphenyl)-1,5-diphenylpenta-2,4-dien-1-imine is sourced from PubChem (CID 134851984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).