3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide

C21H19ClN2O3 — CID 108811025

IUPAC3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
SMILESO=C(CCOc1ccccc1Cl)N(Cc1ccccn1)c1ccccc1O
InChIInChI=1S/C21H19ClN2O3/c22-17-8-1-4-11-20(17)27-14-12-21(26)24(15-16-7-5-6-13-23-16)18-9-2-3-10-19(18)25/h1-11,13,25H,12,14-15H2
InChIKeyCZLRBGLQSWSYGL-UHFFFAOYSA-N
MW382.85 g/mol
LogP4.44
Rot. Bonds7

About 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide

3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 108811025) has the molecular formula C21H19ClN2O3 and a molecular weight of 382.85 g/mol. Its IUPAC name is 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
PubChem CID108811025
Molecular FormulaC21H19ClN2O3
Molecular Weight382.85 g/mol
Exact Mass382.11
IUPAC Name3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
SMILESO=C(CCOc1ccccc1Cl)N(Cc1ccccn1)c1ccccc1O
InChIInChI=1S/C21H19ClN2O3/c22-17-8-1-4-11-20(17)27-14-12-21(26)24(15-16-7-5-6-13-23-16)18-9-2-3-10-19(18)25/h1-11,13,25H,12,14-15H2
InChIKeyCZLRBGLQSWSYGL-UHFFFAOYSA-N
XLogP4.44
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.85
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)butanamide
CID 108756034
4-(2-bromo-4-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)butanamide
CID 108756036
4-chloro-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
CID 108755921
4-(3,4-dimethylphenyl)-N-(2-hydroxyphenyl)-4-oxo-N-(pyridin-2-ylmethyl)butanamide
CID 108732561
2,2,2-trifluoro-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 108755903
4-fluoro-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
CID 108755912
4-ethoxy-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)benzamide
CID 108755953
N-(2-hydroxyphenyl)-2,2-diphenyl-N-(pyridin-2-ylmethyl)acetamide
CID 108755915
2-(1-adamantyl)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 108755936
2-(2-tert-butyl-4-methylphenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)acetamide
CID 108756010
2-[carboxymethyl-[3-(2-chlorophenoxy)propanoyl]amino]acetic acid
CID 63651815
2-[methyl(pyridin-2-ylmethyl)amino]phenol
CID 100991764

Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide (CID 108811025) is 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide is O=C(CCOc1ccccc1Cl)N(Cc1ccccn1)c1ccccc1O.
What is the InChIKey of 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is CZLRBGLQSWSYGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O3/c22-17-8-1-4-11-20(17)27-14-12-21(26)24(15-16-7-5-6-13-23-16)18-9-2-3-10-19(18)25/h1-11,13,25H,12,14-15H2.
What are the key properties of 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 382.85 g/mol, XLogP of 4.44, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenoxy)-N-(2-hydroxyphenyl)-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 108811025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).