N-[1-(4-phenylphenyl)ethylideneamino]hexanamide

C20H24N2O — CID 3111304

IUPACN-[1-(4-phenylphenyl)ethylideneamino]hexanamide
SMILESCCCCCC(=O)NN=C(C)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H24N2O/c1-3-4-6-11-20(23)22-21-16(2)17-12-14-19(15-13-17)18-9-7-5-8-10-18/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H,22,23)
InChIKeyZSBUOVLQIAWKBG-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.77
Rot. Bonds7

About N-[1-(4-phenylphenyl)ethylideneamino]hexanamide

N-[1-(4-phenylphenyl)ethylideneamino]hexanamide (PubChem CID 3111304) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is N-[1-(4-phenylphenyl)ethylideneamino]hexanamide.

Molecular Properties

Compound NameN-[1-(4-phenylphenyl)ethylideneamino]hexanamide
PubChem CID3111304
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC NameN-[1-(4-phenylphenyl)ethylideneamino]hexanamide
SMILESCCCCCC(=O)NN=C(C)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H24N2O/c1-3-4-6-11-20(23)22-21-16(2)17-12-14-19(15-13-17)18-9-7-5-8-10-18/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H,22,23)
InChIKeyZSBUOVLQIAWKBG-UHFFFAOYSA-N
XLogP4.77
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(E)-1-(4-phenylphenyl)ethylideneamino]octanamide
CID 6163036
N,N'-bis(1-phenylethylideneamino)octanediamide
CID 4517497
N-[1-(4-ethylphenyl)ethylideneamino]heptanamide
CID 3659452
N-[(E)-1-(4-aminophenyl)ethylideneamino]decanamide
CID 6177715
N-[1-(4-ethylphenyl)ethylideneamino]nonanamide
CID 4685925
N-[1-(4-chlorophenyl)ethylideneamino]dodecanamide
CID 3558408
N-[(E)-1-(4-hydroxyphenyl)ethylideneamino]pentanamide
CID 135799262
N-[(Z)-1-pyridin-4-ylethylideneamino]nonanamide
CID 6373697
N-[1-(4-ethoxyphenyl)ethylideneamino]heptanamide
CID 3694468
5-[4-[(E)-C-methyl-N-(nonanoylamino)carbonimidoyl]anilino]-5-oxopentanoic acid
CID 6155679
N,N'-bis[1-(4-ethylphenyl)ethylideneamino]hexanediamide
CID 3720428
N-[(E)-heptan-2-ylideneamino]-4-phenylbenzamide
CID 54784798

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-phenylphenyl)ethylideneamino]hexanamide?
The IUPAC name of N-[1-(4-phenylphenyl)ethylideneamino]hexanamide (CID 3111304) is N-[1-(4-phenylphenyl)ethylideneamino]hexanamide.
What is the SMILES notation for N-[1-(4-phenylphenyl)ethylideneamino]hexanamide?
The canonical SMILES for N-[1-(4-phenylphenyl)ethylideneamino]hexanamide is CCCCCC(=O)NN=C(C)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-[1-(4-phenylphenyl)ethylideneamino]hexanamide?
The InChIKey is ZSBUOVLQIAWKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-3-4-6-11-20(23)22-21-16(2)17-12-14-19(15-13-17)18-9-7-5-8-10-18/h5,7-10,12-15H,3-4,6,11H2,1-2H3,(H,22,23).
What are the key properties of N-[1-(4-phenylphenyl)ethylideneamino]hexanamide?
N-[1-(4-phenylphenyl)ethylideneamino]hexanamide has a molecular weight of 308.43 g/mol, XLogP of 4.77, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-phenylphenyl)ethylideneamino]hexanamide is sourced from PubChem (CID 3111304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).