3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole

C14H8Cl2N2O — CID 2726998

IUPAC3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole
SMILESClc1ccc(-c2cc(-c3ccccn3)on2)c(Cl)c1
InChIInChI=1S/C14H8Cl2N2O/c15-9-4-5-10(11(16)7-9)13-8-14(19-18-13)12-3-1-2-6-17-12/h1-8H
InChIKeyLRQLTRSUHLYAHV-UHFFFAOYSA-N
MW291.14 g/mol
LogP4.71
Rot. Bonds2

About 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole

3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole (PubChem CID 2726998) has the molecular formula C14H8Cl2N2O and a molecular weight of 291.14 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole
PubChem CID2726998
Molecular FormulaC14H8Cl2N2O
Molecular Weight291.14 g/mol
Exact Mass290.00
IUPAC Name3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole
SMILESClc1ccc(-c2cc(-c3ccccn3)on2)c(Cl)c1
InChIInChI=1S/C14H8Cl2N2O/c15-9-4-5-10(11(16)7-9)13-8-14(19-18-13)12-3-1-2-6-17-12/h1-8H
InChIKeyLRQLTRSUHLYAHV-UHFFFAOYSA-N
XLogP4.71
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.14
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-(2,4-Dichlorophenyl)isoxazol-5-yl]pyrimidin-2-amine
CID 2745738
5-(4-chlorophenyl)-N-pyridin-3-ylisoxazole-3-carboxamide
CID 15988868
3-(2,4-Dichlorophenyl)-5-(2-methylpyrimidin-4-yl)isoxazole
CID 2745731
5-(2,4-dichlorophenyl)-N-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 1093818
[3-(2,6-Dichlorophenyl)-4-isoxazolyl](2-pyridinyl)methanone
CID 1474304
3-(2,4-Dichlorophenyl)-6-(trifluoromethyl)-[1,2]oxazolo[4,5-b]pyridine
CID 3743953
5-(4-chlorophenyl)-N-(2-chloropyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 5003875
[3-(2-chlorophenyl)-5-methyl-1,2-oxazol-4-yl]({[(1E)-1-(pyridin-4-yl)ethylidene]amino}oxy)methanone
CID 5446268
6-[3-(3-Carbamimidoylphenyl)-1,2-oxazol-5-yl]pyridine-3-carboximidamide;dihydrochloride
CID 90664374
2-[3-(4-Carbamimidoylphenyl)-1,2-oxazol-5-yl]pyridine-4-carboximidamide;dihydrochloride
CID 90664882
6-[3-(4-Carbamimidoylphenyl)-1,2-oxazol-5-yl]pyridine-3-carboximidamide;dihydrochloride
CID 90665128
2-[3-(3-Carbamimidoylphenyl)-1,2-oxazol-5-yl]pyridine-4-carboximidamide;dihydrochloride
CID 90665247

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole?
The IUPAC name of 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole (CID 2726998) is 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole?
The canonical SMILES for 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole is Clc1ccc(-c2cc(-c3ccccn3)on2)c(Cl)c1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole?
The InChIKey is LRQLTRSUHLYAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8Cl2N2O/c15-9-4-5-10(11(16)7-9)13-8-14(19-18-13)12-3-1-2-6-17-12/h1-8H.
What are the key properties of 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole?
3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole has a molecular weight of 291.14 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-5-pyridin-2-yl-1,2-oxazole is sourced from PubChem (CID 2726998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).