N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide

C23H22N2O2 — CID 136831660

IUPACN-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide
SMILESCC/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C23H22N2O2/c1-2-21(17-13-15-20(26)16-14-17)24-25-23(27)22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-16,22,26H,2H2,1H3,(H,25,27)/b24-21-
InChIKeyWFGWDCKEMYOBLW-FLFQWRMESA-N
MW358.44 g/mol
LogP4.45
Rot. Bonds6

About N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide

N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide (PubChem CID 136831660) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide
PubChem CID136831660
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC NameN-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide
SMILESCC/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C23H22N2O2/c1-2-21(17-13-15-20(26)16-14-17)24-25-23(27)22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-16,22,26H,2H2,1H3,(H,25,27)/b24-21-
InChIKeyWFGWDCKEMYOBLW-FLFQWRMESA-N
XLogP4.45
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', '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-hydroxyphenyl)propylideneamino]acetamide
CID 135720029
N'-[1-(4-hydroxyphenyl)propylideneamino]oxamide
CID 4645851
N,N'-bis[(E)-1-(4-hydroxyphenyl)propylideneamino]hexanediamide
CID 135721513
N'-[(E)-1-(4-hydroxyphenyl)propylideneamino]-N-phenylbutanediamide
CID 135560062
4-[(2Z)-2-[1-(4-hydroxyphenyl)propylidene]hydrazinyl]benzoic acid
CID 136713353
4-hydroxy-N-[1-(4-methylphenyl)propylideneamino]benzamide
CID 4622646
N-[(E)-heptan-3-ylideneamino]-2,2-diphenylacetamide
CID 54785044
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]-2-naphthalen-1-ylacetamide
CID 135588935
4-ethyl-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 135673772
2-fluoro-N-[(E)-1-(4-hydroxyphenyl)propylideneamino]benzamide
CID 135609434
N-benzyl-N'-[1-(4-hydroxyphenyl)propylideneamino]butanediamide
CID 5141586
N-[1-(4-fluorophenyl)ethylideneamino]-2,2-diphenylacetamide
CID 827608

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide?
The IUPAC name of N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide (CID 136831660) is N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide.
What is the SMILES notation for N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide?
The canonical SMILES for N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide is CC/C(=N/NC(=O)C(c1ccccc1)c1ccccc1)c1ccc(O)cc1.
What is the InChIKey of N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide?
The InChIKey is WFGWDCKEMYOBLW-FLFQWRMESA-N. The full InChI is InChI=1S/C23H22N2O2/c1-2-21(17-13-15-20(26)16-14-17)24-25-23(27)22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-16,22,26H,2H2,1H3,(H,25,27)/b24-21-.
What are the key properties of N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide?
N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide has a molecular weight of 358.44 g/mol, XLogP of 4.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(4-hydroxyphenyl)propylideneamino]-2,2-diphenylacetamide is sourced from PubChem (CID 136831660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).