2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone

C18H13ClN2O2 — CID 58349292

IUPAC2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1)c1cc(Oc2cccnc2)ccn1
InChIInChI=1S/C18H13ClN2O2/c19-14-4-1-3-13(9-14)10-18(22)17-11-15(6-8-21-17)23-16-5-2-7-20-12-16/h1-9,11-12H,10H2
InChIKeyWJGDLYQJBHUZEO-UHFFFAOYSA-N
MW324.77 g/mol
LogP4.35
Rot. Bonds5

About 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone

2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone (PubChem CID 58349292) has the molecular formula C18H13ClN2O2 and a molecular weight of 324.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone
PubChem CID58349292
Molecular FormulaC18H13ClN2O2
Molecular Weight324.77 g/mol
Exact Mass324.07
IUPAC Name2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone
SMILESO=C(Cc1cccc(Cl)c1)c1cc(Oc2cccnc2)ccn1
InChIInChI=1S/C18H13ClN2O2/c19-14-4-1-3-13(9-14)10-18(22)17-11-15(6-8-21-17)23-16-5-2-7-20-12-16/h1-9,11-12H,10H2
InChIKeyWJGDLYQJBHUZEO-UHFFFAOYSA-N
XLogP4.35
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.77
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-methyl-1,2,4-triazol-3-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone
CID 58349254
2-(2-methyl-4-pyridinyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone;2-(4-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone
CID 123760741
bis(1-[6-(3-chlorophenyl)pyrimidin-4-yl]-2-pyridin-3-ylethanone);hydrochloride
CID 160624132
2-(oxan-4-yl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone
CID 58349315
N-(3-fluorophenyl)-4-pyridin-3-yloxypyridine-2-carboxamide
CID 51038609
3-chloro-N-(3-pyridin-3-yloxyphenyl)benzamide
CID 58337765
2-(3-chlorophenyl)-N-pyrazin-2-ylacetamide
CID 127120451
4-(3-ethylphenoxy)pyridine-2-carboxylic acid
CID 43326028
2-(4-methoxy-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone
CID 58349295
(4-pyridin-3-yloxy-2-pyridinyl)methanol
CID 61255855
2-(3-chlorophenyl)-1-(6-methyl-2-pyridinyl)ethanone
CID 55221466
2-[(3-chloroanilino)methyl]-4-pyridin-3-yloxybenzenesulfinic acid
CID 134343115

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone?
The IUPAC name of 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone (CID 58349292) is 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone?
The canonical SMILES for 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone is O=C(Cc1cccc(Cl)c1)c1cc(Oc2cccnc2)ccn1.
What is the InChIKey of 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone?
The InChIKey is WJGDLYQJBHUZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN2O2/c19-14-4-1-3-13(9-14)10-18(22)17-11-15(6-8-21-17)23-16-5-2-7-20-12-16/h1-9,11-12H,10H2.
What are the key properties of 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone?
2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone has a molecular weight of 324.77 g/mol, XLogP of 4.35, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone is sourced from PubChem (CID 58349292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).