2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide

C24H24N2O5 — CID 135684346

IUPAC2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide
SMILESCOc1ccc(C(O)(C(=O)N/N=C(\C)c2ccccc2O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H24N2O5/c1-16(21-6-4-5-7-22(21)27)25-26-23(28)24(29,17-8-12-19(30-2)13-9-17)18-10-14-20(31-3)15-11-18/h4-15,27,29H,1-3H3,(H,26,28)/b25-16+
InChIKeyKGRTVBJKXSVXKO-PCLIKHOPSA-N
MW420.47 g/mol
LogP3.19
Rot. Bonds7

About 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide

2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide (PubChem CID 135684346) has the molecular formula C24H24N2O5 and a molecular weight of 420.47 g/mol. Its IUPAC name is 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide
PubChem CID135684346
Molecular FormulaC24H24N2O5
Molecular Weight420.47 g/mol
Exact Mass420.17
IUPAC Name2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide
SMILESCOc1ccc(C(O)(C(=O)N/N=C(\C)c2ccccc2O)c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H24N2O5/c1-16(21-6-4-5-7-22(21)27)25-26-23(28)24(29,17-8-12-19(30-2)13-9-17)18-10-14-20(31-3)15-11-18/h4-15,27,29H,1-3H3,(H,26,28)/b25-16+
InChIKeyKGRTVBJKXSVXKO-PCLIKHOPSA-N
XLogP3.19
TPSA100.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
LogP ≤ 53.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', '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-[1-(2-hydroxyphenyl)ethylideneamino]-2-(4-methoxyphenyl)acetamide
CID 3660040
N-[1-(2-hydroxyphenyl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide
CID 914091
N'-[1-(2-hydroxyphenyl)ethylideneamino]-N-(4-methoxyphenyl)oxamide
CID 3527401
2-(4-tert-butylphenoxy)-N-[1-(2-hydroxyphenyl)ethylideneamino]acetamide
CID 921053
4-tert-butyl-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135445579
2-chloro-N-[(E)-1-(2-hydroxy-5-methoxyphenyl)ethylideneamino]benzamide
CID 135824437
N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]acetamide
CID 135767611
N-[(E)-1-(2,4-dihydroxyphenyl)ethylideneamino]-4-methoxybenzamide
CID 135738429
N-[(Z)-1-(2-hydroxyphenyl)ethylideneamino]-2-methoxybenzamide
CID 144899093
2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]benzamide
CID 135472588
(2R)-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2-naphthalen-2-yloxypropanamide
CID 135794374
2-hydroxy-4-methoxy-N-[(Z)-1-naphthalen-1-ylethylideneamino]benzamide
CID 126397741

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide?
The IUPAC name of 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide (CID 135684346) is 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide is COc1ccc(C(O)(C(=O)N/N=C(\C)c2ccccc2O)c2ccc(OC)cc2)cc1.
What is the InChIKey of 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide?
The InChIKey is KGRTVBJKXSVXKO-PCLIKHOPSA-N. The full InChI is InChI=1S/C24H24N2O5/c1-16(21-6-4-5-7-22(21)27)25-26-23(28)24(29,17-8-12-19(30-2)13-9-17)18-10-14-20(31-3)15-11-18/h4-15,27,29H,1-3H3,(H,26,28)/b25-16+.
What are the key properties of 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide?
2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide has a molecular weight of 420.47 g/mol, XLogP of 3.19, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]-2,2-bis(4-methoxyphenyl)acetamide is sourced from PubChem (CID 135684346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).