N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide

C24H25N3O — CID 110515251

IUPACN-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide
SMILESCCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H25N3O/c1-2-27(19-22-11-7-4-8-12-22)23-15-13-21(14-16-23)18-25-26-24(28)17-20-9-5-3-6-10-20/h3-16,18H,2,17,19H2,1H3,(H,26,28)/b25-18-
InChIKeyJWBNIYAYZHBCHO-BWAHOGKJSA-N
MW371.48 g/mol
LogP4.41
Rot. Bonds8

About N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide

N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide (PubChem CID 110515251) has the molecular formula C24H25N3O and a molecular weight of 371.48 g/mol. Its IUPAC name is N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide.

Molecular Properties

Compound NameN-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide
PubChem CID110515251
Molecular FormulaC24H25N3O
Molecular Weight371.48 g/mol
Exact Mass371.20
IUPAC NameN-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide
SMILESCCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)Cc2ccccc2)cc1
InChIInChI=1S/C24H25N3O/c1-2-27(19-22-11-7-4-8-12-22)23-15-13-21(14-16-23)18-25-26-24(28)17-20-9-5-3-6-10-20/h3-16,18H,2,17,19H2,1H3,(H,26,28)/b25-18-
InChIKeyJWBNIYAYZHBCHO-BWAHOGKJSA-N
XLogP4.41
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-2-phenylacetamide
CID 5404499
methyl N-[[4-[benzyl(ethyl)amino]phenyl]methylideneamino]carbamate
CID 2361352
N-[(E)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-4-(diethylamino)benzamide
CID 6900909
N-[[4-(diethylamino)phenyl]methylideneamino]-3-phenylpropanamide
CID 824175
[(E)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]thiourea
CID 6902327
N-benzyl-4-[(benzylhydrazinylidene)methyl]-N-ethylaniline
CID 110839639
N-[[4-(diethylamino)phenyl]methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 968719
N-[(Z)-[4-(diethylamino)phenyl]methylideneamino]-2-(4-methoxyphenyl)acetamide
CID 5428293
N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-3,5-dimethoxybenzamide
CID 7966329
N-[[4-[benzyl(ethyl)amino]phenyl]methylidene]hydroxylamine
CID 2394003
N-[(E)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-4-nitrobenzamide
CID 110506592
1-[[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-3-prop-2-enylthiourea
CID 2382134

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide?
The IUPAC name of N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide (CID 110515251) is N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide.
What is the SMILES notation for N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide?
The canonical SMILES for N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide is CCN(Cc1ccccc1)c1ccc(/C=N\NC(=O)Cc2ccccc2)cc1.
What is the InChIKey of N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide?
The InChIKey is JWBNIYAYZHBCHO-BWAHOGKJSA-N. The full InChI is InChI=1S/C24H25N3O/c1-2-27(19-22-11-7-4-8-12-22)23-15-13-21(14-16-23)18-25-26-24(28)17-20-9-5-3-6-10-20/h3-16,18H,2,17,19H2,1H3,(H,26,28)/b25-18-.
What are the key properties of N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide?
N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide has a molecular weight of 371.48 g/mol, XLogP of 4.41, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-phenylacetamide is sourced from PubChem (CID 110515251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).