2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol

C11H15NO2 — CID 117228509

IUPAC2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol
SMILESCC1COC(C)(c2ccccc2O)N1
InChIInChI=1S/C11H15NO2/c1-8-7-14-11(2,12-8)9-5-3-4-6-10(9)13/h3-6,8,12-13H,7H2,1-2H3
InChIKeyMFKUJYCFJLXPBP-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.57
Rot. Bonds1

About 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol

2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol (PubChem CID 117228509) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol.

Molecular Properties

Compound Name2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol
PubChem CID117228509
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol
SMILESCC1COC(C)(c2ccccc2O)N1
InChIInChI=1S/C11H15NO2/c1-8-7-14-11(2,12-8)9-5-3-4-6-10(9)13/h3-6,8,12-13H,7H2,1-2H3
InChIKeyMFKUJYCFJLXPBP-UHFFFAOYSA-N
XLogP1.57
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

2,4-dimethyl-2-pyridin-2-yl-1,3-oxazolidine
CID 117228214
2-(3-fluorophenyl)-2,4-dimethyl-1,3-oxazolidine
CID 117228450
2-(3-bromophenyl)-2,4-dimethyl-1,3-oxazolidine
CID 117228454
2-(5-chlorofuran-2-yl)-2,4-dimethyl-1,3-oxazolidine;hydrochloride
CID 117228177
(4S)-2-ethyl-4-methyl-2-phenyl-1,3-oxazolidine
CID 129299328
2-[(2-methoxyphenyl)methyl]-2,4-dimethyl-1,3-oxazolidine
CID 117228325
2,4-dimethyl-2-(thiophen-2-ylmethyl)-1,3-oxazolidine;hydrochloride
CID 117228639
2-(3,3-difluoro-2-methyloxiran-2-yl)phenol
CID 130034849
4-(2-hydroxyphenyl)-1,4-dimethylimidazolidin-2-one
CID 105458761
2-[1-[2-(2-hydroxyphenyl)-3-methyloxiran-2-yl]ethyl]phenol
CID 87650282
3-(2,5-dimethyl-1,3-oxazinan-2-yl)phenol
CID 117227041
2-(2-propyl-1,3-dioxolan-2-yl)phenol
CID 83957796

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol?
The IUPAC name of 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol (CID 117228509) is 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol.
What is the SMILES notation for 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol?
The canonical SMILES for 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol is CC1COC(C)(c2ccccc2O)N1.
What is the InChIKey of 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol?
The InChIKey is MFKUJYCFJLXPBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-8-7-14-11(2,12-8)9-5-3-4-6-10(9)13/h3-6,8,12-13H,7H2,1-2H3.
What are the key properties of 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol?
2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol has a molecular weight of 193.25 g/mol, XLogP of 1.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethyl-1,3-oxazolidin-2-yl)phenol is sourced from PubChem (CID 117228509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).