5-(2,4-dichlorophenyl)-1,3-oxazolidine

C9H9Cl2NO — CID 142653590

IUPAC5-(2,4-dichlorophenyl)-1,3-oxazolidine
SMILESClc1ccc(C2CNCO2)c(Cl)c1
InChIInChI=1S/C9H9Cl2NO/c10-6-1-2-7(8(11)3-6)9-4-12-5-13-9/h1-3,9,12H,4-5H2
InChIKeyIYNOMDWELKUHNT-UHFFFAOYSA-N
MW218.08 g/mol
LogP2.61
Rot. Bonds1

About 5-(2,4-dichlorophenyl)-1,3-oxazolidine

5-(2,4-dichlorophenyl)-1,3-oxazolidine (PubChem CID 142653590) has the molecular formula C9H9Cl2NO and a molecular weight of 218.08 g/mol. Its IUPAC name is 5-(2,4-dichlorophenyl)-1,3-oxazolidine.

Molecular Properties

Compound Name5-(2,4-dichlorophenyl)-1,3-oxazolidine
PubChem CID142653590
Molecular FormulaC9H9Cl2NO
Molecular Weight218.08 g/mol
Exact Mass217.01
IUPAC Name5-(2,4-dichlorophenyl)-1,3-oxazolidine
SMILESClc1ccc(C2CNCO2)c(Cl)c1
InChIInChI=1S/C9H9Cl2NO/c10-6-1-2-7(8(11)3-6)9-4-12-5-13-9/h1-3,9,12H,4-5H2
InChIKeyIYNOMDWELKUHNT-UHFFFAOYSA-N
XLogP2.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.08
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 161270720
CID 161270720
5-(3,5-dichloro-2-methoxyphenyl)-1,3-oxazolidine
CID 82480088
5-(3-chlorophenyl)-1,3-oxazolidine
CID 15261641
5-(2,5-dichloro-4-methoxyphenyl)-1,3-oxazolidine
CID 82480089
3-(2,4-dichlorophenyl)-2,3,5,5a,6,7,8,8a-octahydro-1H-cyclopenta[e][1,4]oxazepine
CID 114179159
5-(2,4-dichlorophenyl)-1,3-oxathiolane-2-thione
CID 132535937
5-chloro-2-morpholin-2-ylbenzoic acid
CID 174949495
2-(4-bromo-2-chlorophenyl)-6-methylmorpholine
CID 82779010
2-[2-chloro-4-(1,1-difluoroethyl)phenyl]morpholine
CID 117409073
(5R,6R)-5,6-dibromo-2-(2,4-dichlorophenyl)-1,3-dioxepane
CID 7032956
2-(2,5-dichlorophenyl)-6,6-diethyl-1,4-oxazepane
CID 106253389
5-(3-methoxyphenyl)-1,3-oxazolidine
CID 82280696

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dichlorophenyl)-1,3-oxazolidine?
The IUPAC name of 5-(2,4-dichlorophenyl)-1,3-oxazolidine (CID 142653590) is 5-(2,4-dichlorophenyl)-1,3-oxazolidine.
What is the SMILES notation for 5-(2,4-dichlorophenyl)-1,3-oxazolidine?
The canonical SMILES for 5-(2,4-dichlorophenyl)-1,3-oxazolidine is Clc1ccc(C2CNCO2)c(Cl)c1.
What is the InChIKey of 5-(2,4-dichlorophenyl)-1,3-oxazolidine?
The InChIKey is IYNOMDWELKUHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Cl2NO/c10-6-1-2-7(8(11)3-6)9-4-12-5-13-9/h1-3,9,12H,4-5H2.
What are the key properties of 5-(2,4-dichlorophenyl)-1,3-oxazolidine?
5-(2,4-dichlorophenyl)-1,3-oxazolidine has a molecular weight of 218.08 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dichlorophenyl)-1,3-oxazolidine is sourced from PubChem (CID 142653590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).