6-(4-chlorophenyl)-2-methyloxazinane

C11H14ClNO — CID 548199

IUPAC6-(4-chlorophenyl)-2-methyloxazinane
SMILESCN1CCCC(c2ccc(Cl)cc2)O1
InChIInChI=1S/C11H14ClNO/c1-13-8-2-3-11(14-13)9-4-6-10(12)7-5-9/h4-7,11H,2-3,8H2,1H3
InChIKeyDAHISRJDRDHLFM-UHFFFAOYSA-N
MW211.69 g/mol
LogP3.04
Rot. Bonds1

About 6-(4-chlorophenyl)-2-methyloxazinane

6-(4-chlorophenyl)-2-methyloxazinane (PubChem CID 548199) has the molecular formula C11H14ClNO and a molecular weight of 211.69 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-2-methyloxazinane.

Molecular Properties

Compound Name6-(4-chlorophenyl)-2-methyloxazinane
PubChem CID548199
Molecular FormulaC11H14ClNO
Molecular Weight211.69 g/mol
Exact Mass211.08
IUPAC Name6-(4-chlorophenyl)-2-methyloxazinane
SMILESCN1CCCC(c2ccc(Cl)cc2)O1
InChIInChI=1S/C11H14ClNO/c1-13-8-2-3-11(14-13)9-4-6-10(12)7-5-9/h4-7,11H,2-3,8H2,1H3
InChIKeyDAHISRJDRDHLFM-UHFFFAOYSA-N
XLogP3.04
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.69
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-2-methyloxazinane?
The IUPAC name of 6-(4-chlorophenyl)-2-methyloxazinane (CID 548199) is 6-(4-chlorophenyl)-2-methyloxazinane.
What is the SMILES notation for 6-(4-chlorophenyl)-2-methyloxazinane?
The canonical SMILES for 6-(4-chlorophenyl)-2-methyloxazinane is CN1CCCC(c2ccc(Cl)cc2)O1.
What is the InChIKey of 6-(4-chlorophenyl)-2-methyloxazinane?
The InChIKey is DAHISRJDRDHLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO/c1-13-8-2-3-11(14-13)9-4-6-10(12)7-5-9/h4-7,11H,2-3,8H2,1H3.
What are the key properties of 6-(4-chlorophenyl)-2-methyloxazinane?
6-(4-chlorophenyl)-2-methyloxazinane has a molecular weight of 211.69 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-2-methyloxazinane is sourced from PubChem (CID 548199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).