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

C10H13NO2 — CID 11367345

IUPAC4-(3-methyl-1,3-oxazolidin-2-yl)phenol
SMILESCN1CCOC1c1ccc(O)cc1
InChIInChI=1S/C10H13NO2/c1-11-6-7-13-10(11)8-2-4-9(12)5-3-8/h2-5,10,12H,6-7H2,1H3
InChIKeyTYVBDKQUZNZDDW-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.35
Rot. Bonds1

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

4-(3-methyl-1,3-oxazolidin-2-yl)phenol (PubChem CID 11367345) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 4-(3-methyl-1,3-oxazolidin-2-yl)phenol.

Molecular Properties

Compound Name4-(3-methyl-1,3-oxazolidin-2-yl)phenol
PubChem CID11367345
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name4-(3-methyl-1,3-oxazolidin-2-yl)phenol
SMILESCN1CCOC1c1ccc(O)cc1
InChIInChI=1S/C10H13NO2/c1-11-6-7-13-10(11)8-2-4-9(12)5-3-8/h2-5,10,12H,6-7H2,1H3
InChIKeyTYVBDKQUZNZDDW-UHFFFAOYSA-N
XLogP1.35
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-1,3-oxazolidin-2-yl)phenol?
The IUPAC name of 4-(3-methyl-1,3-oxazolidin-2-yl)phenol (CID 11367345) is 4-(3-methyl-1,3-oxazolidin-2-yl)phenol.
What is the SMILES notation for 4-(3-methyl-1,3-oxazolidin-2-yl)phenol?
The canonical SMILES for 4-(3-methyl-1,3-oxazolidin-2-yl)phenol is CN1CCOC1c1ccc(O)cc1.
What is the InChIKey of 4-(3-methyl-1,3-oxazolidin-2-yl)phenol?
The InChIKey is TYVBDKQUZNZDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-11-6-7-13-10(11)8-2-4-9(12)5-3-8/h2-5,10,12H,6-7H2,1H3.
What are the key properties of 4-(3-methyl-1,3-oxazolidin-2-yl)phenol?
4-(3-methyl-1,3-oxazolidin-2-yl)phenol has a molecular weight of 179.22 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-1,3-oxazolidin-2-yl)phenol is sourced from PubChem (CID 11367345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).