2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide

C20H20Cl2N2O2 — CID 1254775

IUPAC2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide
SMILESO=C(NN=C1CCCCC1)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H20Cl2N2O2/c21-16-10-6-14(7-11-16)20(26,15-8-12-17(22)13-9-15)19(25)24-23-18-4-2-1-3-5-18/h6-13,26H,1-5H2,(H,24,25)
InChIKeyIQGGAJUGRSSLKJ-UHFFFAOYSA-N
MW391.30 g/mol
LogP4.67
Rot. Bonds4

About 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide

2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide (PubChem CID 1254775) has the molecular formula C20H20Cl2N2O2 and a molecular weight of 391.30 g/mol. Its IUPAC name is 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide.

Molecular Properties

Compound Name2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide
PubChem CID1254775
Molecular FormulaC20H20Cl2N2O2
Molecular Weight391.30 g/mol
Exact Mass390.09
IUPAC Name2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide
SMILESO=C(NN=C1CCCCC1)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C20H20Cl2N2O2/c21-16-10-6-14(7-11-16)20(26,15-8-12-17(22)13-9-15)19(25)24-23-18-4-2-1-3-5-18/h6-13,26H,1-5H2,(H,24,25)
InChIKeyIQGGAJUGRSSLKJ-UHFFFAOYSA-N
XLogP4.67
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.30
LogP ≤ 54.67
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 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide?
The IUPAC name of 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide (CID 1254775) is 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide.
What is the SMILES notation for 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide?
The canonical SMILES for 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide is O=C(NN=C1CCCCC1)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1.
What is the InChIKey of 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide?
The InChIKey is IQGGAJUGRSSLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20Cl2N2O2/c21-16-10-6-14(7-11-16)20(26,15-8-12-17(22)13-9-15)19(25)24-23-18-4-2-1-3-5-18/h6-13,26H,1-5H2,(H,24,25).
What are the key properties of 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide?
2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide has a molecular weight of 391.30 g/mol, XLogP of 4.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(4-chlorophenyl)-N-(cyclohexylideneamino)-2-hydroxyacetamide is sourced from PubChem (CID 1254775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).