(Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine

C30H28N2 — CID 6370993

IUPAC(Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine
SMILESc1ccc(CC/C(=N/N=C(\CCc2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C30H28N2/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27)31-32-30(28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H,21-24H2/b31-29-,32-30+
InChIKeyAROHHHHPQBMXPI-SNQKRLHOSA-N
MW416.57 g/mol
LogP7.15
Rot. Bonds9

About (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine

(Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine (PubChem CID 6370993) has the molecular formula C30H28N2 and a molecular weight of 416.57 g/mol. Its IUPAC name is (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine.

Molecular Properties

Compound Name(Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine
PubChem CID6370993
Molecular FormulaC30H28N2
Molecular Weight416.57 g/mol
Exact Mass416.23
IUPAC Name(Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine
SMILESc1ccc(CC/C(=N/N=C(\CCc2ccccc2)c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C30H28N2/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27)31-32-30(28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H,21-24H2/b31-29-,32-30+
InChIKeyAROHHHHPQBMXPI-SNQKRLHOSA-N
XLogP7.15
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.57
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

4-[(3-carboxy-1-phenylpropylidene)hydrazinylidene]-4-phenylbutanoic acid
CID 2834574
2-(1,2-diphenylethylideneamino)guanidine
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3-phenyl-N-(1-phenylpropylideneamino)propanamide
CID 5163167
3-phenyl-N-[(Z)-1-phenylpropylideneamino]propanamide
CID 6288373
(Z)-1,2-diphenyl-N-[(Z)-1-phenylethylideneamino]ethanimine
CID 6377356
2-(1-phenylbutylideneamino)guanidine
CID 76872532
3-phenylbut-3-enylbenzene;(2-phenylcyclobutyl)benzene
CID 157174978
2-[(E)-N-hydroxy-C-(2-phenylethyl)carbonimidoyl]phenol;hydrate
CID 137291939
benzoyl iodide;3-phenylpropanoic acid
CID 143765725
[4-phenyl-2-(2-phenylethyl)but-1-enyl]phosphane
CID 91156362
benzene;2-phenylethylbenzene
CID 18982764
[(E)-3-methylidenehex-4-enyl]benzene
CID 15074252

Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine?
The IUPAC name of (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine (CID 6370993) is (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine.
What is the SMILES notation for (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine?
The canonical SMILES for (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine is c1ccc(CC/C(=N/N=C(\CCc2ccccc2)c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine?
The InChIKey is AROHHHHPQBMXPI-SNQKRLHOSA-N. The full InChI is InChI=1S/C30H28N2/c1-5-13-25(14-6-1)21-23-29(27-17-9-3-10-18-27)31-32-30(28-19-11-4-12-20-28)24-22-26-15-7-2-8-16-26/h1-20H,21-24H2/b31-29-,32-30+.
What are the key properties of (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine?
(Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine has a molecular weight of 416.57 g/mol, XLogP of 7.15, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(E)-1,3-diphenylpropylideneamino]-1,3-diphenylpropan-1-imine is sourced from PubChem (CID 6370993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).