2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide

C18H20N2O2 — CID 4547261

IUPAC2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide
SMILESCC(C)C=NNC(=O)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-14(2)13-19-20-17(21)18(22,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,22H,1-2H3,(H,20,21)
InChIKeyCCEXUMSZYZHSII-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.68
Rot. Bonds5

About 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide

2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide (PubChem CID 4547261) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide
PubChem CID4547261
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide
SMILESCC(C)C=NNC(=O)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20N2O2/c1-14(2)13-19-20-17(21)18(22,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,22H,1-2H3,(H,20,21)
InChIKeyCCEXUMSZYZHSII-UHFFFAOYSA-N
XLogP2.68
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.68
H-Bond Donors ≤ 52
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

2-hydroxy-N-[(E)-[(2E)-2-[(2-hydroxy-2,2-diphenylacetyl)hydrazinylidene]ethylidene]amino]-2,2-diphenylacetamide
CID 46495023
2-hydroxy-N-[(2-methyl-3-phenylprop-2-enylidene)amino]-2,2-diphenylacetamide
CID 4156814
methyl 4-[[(2-hydroxy-2,2-diphenylacetyl)hydrazinylidene]methyl]benzoate
CID 3753828
2-hydroxy-N-[(E)-(4-hydroxy-3,5-dimethylphenyl)methylideneamino]-2,2-diphenylacetamide
CID 135765568
N-[(Z)-(3,5-ditert-butyl-4-hydroxyphenyl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide
CID 136794022
N-[(E)-(3,5-dimethoxyphenyl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide
CID 134094114
N-[(Z)-(3,5-dibromo-2,4-dihydroxyphenyl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide
CID 135781632
2-hydroxy-N-[(Z)-(2-hydroxy-4-methylphenyl)methylideneamino]-2,2-diphenylacetamide
CID 136713953
2-hydroxy-N-[(Z)-(3-methylthiophen-2-yl)methylideneamino]-2,2-diphenylacetamide
CID 6259909
2-hydroxy-2,2-diphenyl-N-[(2,4,5-trimethoxyphenyl)methylideneamino]acetamide
CID 3486286
2-hydroxy-N-[(2-hydroxy-5-methylphenyl)methylideneamino]-2,2-diphenylacetamide
CID 3317398
2-hydroxy-N-[(E)-(2-hydroxy-3-methylphenyl)methylideneamino]-2,2-diphenylacetamide
CID 135533066

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide?
The IUPAC name of 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide (CID 4547261) is 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide.
What is the SMILES notation for 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide?
The canonical SMILES for 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide is CC(C)C=NNC(=O)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide?
The InChIKey is CCEXUMSZYZHSII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-14(2)13-19-20-17(21)18(22,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-14,22H,1-2H3,(H,20,21).
What are the key properties of 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide?
2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide has a molecular weight of 296.37 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(2-methylpropylideneamino)-2,2-diphenylacetamide is sourced from PubChem (CID 4547261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).