N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide

C22H21N3O2 — CID 4215253

IUPACN-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide
SMILESCC(=NNC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(N)cc1
InChIInChI=1S/C22H21N3O2/c1-16(17-12-14-20(23)15-13-17)24-25-21(26)22(27,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-15,27H,23H2,1H3,(H,25,26)
InChIKeyBAZDIXDBVWUKBZ-UHFFFAOYSA-N
MW359.43 g/mol
LogP3.05
Rot. Bonds5

About N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide

N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide (PubChem CID 4215253) has the molecular formula C22H21N3O2 and a molecular weight of 359.43 g/mol. Its IUPAC name is N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide
PubChem CID4215253
Molecular FormulaC22H21N3O2
Molecular Weight359.43 g/mol
Exact Mass359.16
IUPAC NameN-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide
SMILESCC(=NNC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(N)cc1
InChIInChI=1S/C22H21N3O2/c1-16(17-12-14-20(23)15-13-17)24-25-21(26)22(27,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-15,27H,23H2,1H3,(H,25,26)
InChIKeyBAZDIXDBVWUKBZ-UHFFFAOYSA-N
XLogP3.05
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_anil(14)', 'substructure': 'N/A'}, {'alert_name': 'aniline', '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

2-hydroxy-N-[1-(3-methylphenyl)ethylideneamino]-2,2-diphenylacetamide
CID 3337584
4-amino-N-[1-(4-tert-butylphenyl)ethylideneamino]benzamide
CID 3435127
1-N,4-N-bis[1-(4-aminophenyl)ethylideneamino]benzene-1,4-dicarboxamide
CID 4998105
2-hydroxy-N-[1-(4-methoxy-3-nitrophenyl)ethylideneamino]-2,2-diphenylacetamide
CID 1113261
2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide
CID 4547261
2,2,2-trifluoro-N-[1-(4-phenylphenyl)ethylideneamino]acetamide
CID 1136936
ethyl 2-amino-5-[N-[(2-hydroxy-2,2-diphenylacetyl)amino]-C-methylcarbonimidoyl]-4-methylthiophene-3-carboxylate
CID 3494169
N-[(Z)-1-(4-aminophenyl)ethylideneamino]-4-methylbenzamide
CID 6041987
2-hydroxy-N-[(E)-1-(4-hydroxy-6-methyl-2-oxopyran-3-yl)ethylideneamino]-2,2-diphenylacetamide
CID 135411294
2,4-dichloro-N-[3-[(Z)-N-[(2-hydroxy-2,2-diphenylacetyl)amino]-C-methylcarbonimidoyl]phenyl]benzamide
CID 6261065
2,2-bis(4-aminophenyl)-2-hydroxy-N-phenylacetamide
CID 139899649
[1-(4-tert-butylphenyl)ethylideneamino]urea
CID 5041387

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide?
The IUPAC name of N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide (CID 4215253) is N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide.
What is the SMILES notation for N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide?
The canonical SMILES for N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide is CC(=NNC(=O)C(O)(c1ccccc1)c1ccccc1)c1ccc(N)cc1.
What is the InChIKey of N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide?
The InChIKey is BAZDIXDBVWUKBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O2/c1-16(17-12-14-20(23)15-13-17)24-25-21(26)22(27,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-15,27H,23H2,1H3,(H,25,26).
What are the key properties of N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide?
N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide has a molecular weight of 359.43 g/mol, XLogP of 3.05, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-aminophenyl)ethylideneamino]-2-hydroxy-2,2-diphenylacetamide is sourced from PubChem (CID 4215253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).