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

C20H22N2O2 — CID 780085

IUPACN-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide
SMILESO=C(NN=C1CCCCC1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O2/c23-19(22-21-18-14-8-3-9-15-18)20(24,16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,24H,3,8-9,14-15H2,(H,22,23)
InChIKeyQOVIMRBMRASYHP-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.36
Rot. Bonds4

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

N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide (PubChem CID 780085) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide
PubChem CID780085
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide
SMILESO=C(NN=C1CCCCC1)C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H22N2O2/c23-19(22-21-18-14-8-3-9-15-18)20(24,16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,24H,3,8-9,14-15H2,(H,22,23)
InChIKeyQOVIMRBMRASYHP-UHFFFAOYSA-N
XLogP3.36
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.36
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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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide?
The IUPAC name of N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide (CID 780085) is N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide.
What is the SMILES notation for N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide?
The canonical SMILES for N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide is O=C(NN=C1CCCCC1)C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide?
The InChIKey is QOVIMRBMRASYHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c23-19(22-21-18-14-8-3-9-15-18)20(24,16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13,24H,3,8-9,14-15H2,(H,22,23).
What are the key properties of N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide?
N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide has a molecular weight of 322.41 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylideneamino)-2-hydroxy-2,2-diphenylacetamide is sourced from PubChem (CID 780085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).