3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide

C21H20N2O3 — CID 108732529

IUPAC3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
SMILESCCOc1cccc(C(=O)N(Cc2ccccn2)c2ccccc2O)c1
InChIInChI=1S/C21H20N2O3/c1-2-26-18-10-7-8-16(14-18)21(25)23(15-17-9-5-6-13-22-17)19-11-3-4-12-20(19)24/h3-14,24H,2,15H2,1H3
InChIKeyZQWGPNYRCAYMKT-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.03
Rot. Bonds6

About 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide

3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 108732529) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
PubChem CID108732529
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC Name3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
SMILESCCOc1cccc(C(=O)N(Cc2ccccn2)c2ccccc2O)c1
InChIInChI=1S/C21H20N2O3/c1-2-26-18-10-7-8-16(14-18)21(25)23(15-17-9-5-6-13-22-17)19-11-3-4-12-20(19)24/h3-14,24H,2,15H2,1H3
InChIKeyZQWGPNYRCAYMKT-UHFFFAOYSA-N
XLogP4.03
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.40
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxyphenyl)-3-methoxy-N-(pyridin-2-ylmethyl)benzamide
CID 108755925
4-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
CID 108755953
N-(2-hydroxyphenyl)-3-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 108732451
3-ethoxy-N-[(4-ethylphenyl)methyl]-N-pyridin-2-ylbenzamide
CID 17012477
4-fluoro-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
CID 108755912
4-chloro-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
CID 108755921
N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)-3,5-bis(trifluoromethyl)benzamide
CID 108756043
4-chloro-N-(2-hydroxyphenyl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide
CID 108732452
3-butoxy-N-(4-propan-2-yl-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 43987656
3-butoxy-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 41056401
N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)-3-(trifluoromethyl)benzamide
CID 41055880
4-butoxy-N-(6-ethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 41055872

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide (CID 108732529) is 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide is CCOc1cccc(C(=O)N(Cc2ccccn2)c2ccccc2O)c1.
What is the InChIKey of 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is ZQWGPNYRCAYMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-2-26-18-10-7-8-16(14-18)21(25)23(15-17-9-5-6-13-22-17)19-11-3-4-12-20(19)24/h3-14,24H,2,15H2,1H3.
What are the key properties of 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide?
3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 348.40 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 108732529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).