N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide

C24H21N3O3 — CID 1356442

IUPACN-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide
SMILESCCn1c(O)c(/N=N/C(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc21
InChIInChI=1S/C24H21N3O3/c1-2-27-20-16-10-9-15-19(20)21(22(27)28)25-26-23(29)24(30,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-16,28,30H,2H2,1H3/b26-25+
InChIKeyQYRZMPYNXHHVKX-OCEACIFDSA-N
MW399.45 g/mol
LogP4.91
Rot. Bonds5

About N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide

N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide (PubChem CID 1356442) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide
PubChem CID1356442
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC NameN-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide
SMILESCCn1c(O)c(/N=N/C(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc21
InChIInChI=1S/C24H21N3O3/c1-2-27-20-16-10-9-15-19(20)21(22(27)28)25-26-23(29)24(30,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-16,28,30H,2H2,1H3/b26-25+
InChIKeyQYRZMPYNXHHVKX-OCEACIFDSA-N
XLogP4.91
TPSA87.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-phenoxyacetamide
CID 963929
4-amino-N-(1-ethyl-2-hydroxyindol-3-yl)iminobenzamide
CID 2642229
N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-(2-methoxyanilino)acetamide
CID 3605087
N-(2-hydroxy-1-propylindol-3-yl)iminobenzamide
CID 5030390
4-ethoxy-N-(1-ethyl-2-hydroxyindol-3-yl)iminobenzamide
CID 135577272
N-(1-ethyl-2-hydroxyindol-3-yl)imino-3,5-dinitrobenzamide
CID 3522953
tert-butyl N-(1-hexyl-2-hydroxyindol-3-yl)iminocarbamate
CID 135881483
2-(2-chlorophenoxy)-N-(1-ethyl-2-hydroxyindol-3-yl)iminoacetamide
CID 135674715
3-ethyl-N-(1-ethyl-2-hydroxyindol-3-yl)imino-4-oxophthalazine-1-carboxamide
CID 135749649
(3R,4R)-N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-oxo-4-phenylpyrrolidine-3-carboxamide
CID 135554869
methyl N-(2-hydroxy-1-pentylindol-3-yl)iminocarbamate
CID 2692604
cis-(1S,2R)-2-(4-tert-butylphenyl)-N-(2-hydroxy-1-propylindol-3-yl)iminocyclopropane-1-carboxamide
CID 137231616

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide?
The IUPAC name of N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide (CID 1356442) is N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide.
What is the SMILES notation for N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide?
The canonical SMILES for N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide is CCn1c(O)c(/N=N/C(=O)C(O)(c2ccccc2)c2ccccc2)c2ccccc21.
What is the InChIKey of N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide?
The InChIKey is QYRZMPYNXHHVKX-OCEACIFDSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-2-27-20-16-10-9-15-19(20)21(22(27)28)25-26-23(29)24(30,17-11-5-3-6-12-17)18-13-7-4-8-14-18/h3-16,28,30H,2H2,1H3/b26-25+.
What are the key properties of N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide?
N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide has a molecular weight of 399.45 g/mol, XLogP of 4.91, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-2-hydroxyindol-3-yl)imino-2-hydroxy-2,2-diphenylacetamide is sourced from PubChem (CID 1356442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).