2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine

C16H17ClN2O2 — CID 21389811

IUPAC2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine
SMILESCCOC1CC(c2ccccn2)N(c2ccc(Cl)cc2)O1
InChIInChI=1S/C16H17ClN2O2/c1-2-20-16-11-15(14-5-3-4-10-18-14)19(21-16)13-8-6-12(17)7-9-13/h3-10,15-16H,2,11H2,1H3
InChIKeyNXKIZLXEWNZHNM-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.98
Rot. Bonds4

About 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine

2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine (PubChem CID 21389811) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine
PubChem CID21389811
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC Name2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine
SMILESCCOC1CC(c2ccccn2)N(c2ccc(Cl)cc2)O1
InChIInChI=1S/C16H17ClN2O2/c1-2-20-16-11-15(14-5-3-4-10-18-14)19(21-16)13-8-6-12(17)7-9-13/h3-10,15-16H,2,11H2,1H3
InChIKeyNXKIZLXEWNZHNM-UHFFFAOYSA-N
XLogP3.98
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine?
The IUPAC name of 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine (CID 21389811) is 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine.
What is the SMILES notation for 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine?
The canonical SMILES for 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine is CCOC1CC(c2ccccn2)N(c2ccc(Cl)cc2)O1.
What is the InChIKey of 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine?
The InChIKey is NXKIZLXEWNZHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c1-2-20-16-11-15(14-5-3-4-10-18-14)19(21-16)13-8-6-12(17)7-9-13/h3-10,15-16H,2,11H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine?
2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine has a molecular weight of 304.78 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-ethoxy-3-pyridin-2-yl-1,2-oxazolidine is sourced from PubChem (CID 21389811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).