5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide

C21H18ClNO2 — CID 90665763

IUPAC5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide
SMILESO=C(NCC(c1ccccc1)c1ccccc1)c1cc(Cl)ccc1O
InChIInChI=1S/C21H18ClNO2/c22-17-11-12-20(24)18(13-17)21(25)23-14-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,19,24H,14H2,(H,23,25)
InChIKeyOZIYOEBZINSDRE-UHFFFAOYSA-N
MW351.83 g/mol
LogP4.61
Rot. Bonds5

About 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide

5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide (PubChem CID 90665763) has the molecular formula C21H18ClNO2 and a molecular weight of 351.83 g/mol. Its IUPAC name is 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide
PubChem CID90665763
Molecular FormulaC21H18ClNO2
Molecular Weight351.83 g/mol
Exact Mass351.10
IUPAC Name5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide
SMILESO=C(NCC(c1ccccc1)c1ccccc1)c1cc(Cl)ccc1O
InChIInChI=1S/C21H18ClNO2/c22-17-11-12-20(24)18(13-17)21(25)23-14-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,19,24H,14H2,(H,23,25)
InChIKeyOZIYOEBZINSDRE-UHFFFAOYSA-N
XLogP4.61
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.83
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide (CID 90665763) is 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide is O=C(NCC(c1ccccc1)c1ccccc1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide?
The InChIKey is OZIYOEBZINSDRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClNO2/c22-17-11-12-20(24)18(13-17)21(25)23-14-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13,19,24H,14H2,(H,23,25).
What are the key properties of 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide?
5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide has a molecular weight of 351.83 g/mol, XLogP of 4.61, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,2-diphenylethyl)-2-hydroxybenzamide is sourced from PubChem (CID 90665763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).