4-benzyl-2-methyl-1,3-oxazolidine

C11H15NO — CID 82280019

IUPAC4-benzyl-2-methyl-1,3-oxazolidine
SMILESCC1NC(Cc2ccccc2)CO1
InChIInChI=1S/C11H15NO/c1-9-12-11(8-13-9)7-10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3
InChIKeyOMTOPZQEBUXGBO-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.56
Rot. Bonds2

About 4-benzyl-2-methyl-1,3-oxazolidine

4-benzyl-2-methyl-1,3-oxazolidine (PubChem CID 82280019) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-benzyl-2-methyl-1,3-oxazolidine.

Molecular Properties

Compound Name4-benzyl-2-methyl-1,3-oxazolidine
PubChem CID82280019
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name4-benzyl-2-methyl-1,3-oxazolidine
SMILESCC1NC(Cc2ccccc2)CO1
InChIInChI=1S/C11H15NO/c1-9-12-11(8-13-9)7-10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3
InChIKeyOMTOPZQEBUXGBO-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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4-benzyl-1,3-oxazolidine
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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-2-methyl-1,3-oxazolidine?
The IUPAC name of 4-benzyl-2-methyl-1,3-oxazolidine (CID 82280019) is 4-benzyl-2-methyl-1,3-oxazolidine.
What is the SMILES notation for 4-benzyl-2-methyl-1,3-oxazolidine?
The canonical SMILES for 4-benzyl-2-methyl-1,3-oxazolidine is CC1NC(Cc2ccccc2)CO1.
What is the InChIKey of 4-benzyl-2-methyl-1,3-oxazolidine?
The InChIKey is OMTOPZQEBUXGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-9-12-11(8-13-9)7-10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3.
What are the key properties of 4-benzyl-2-methyl-1,3-oxazolidine?
4-benzyl-2-methyl-1,3-oxazolidine has a molecular weight of 177.25 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-2-methyl-1,3-oxazolidine is sourced from PubChem (CID 82280019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).