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

C10H13NO2 — CID 117228504

IUPAC2-(4-methyl-1,3-oxazolidin-2-yl)phenol
SMILESCC1COC(c2ccccc2O)N1
InChIInChI=1S/C10H13NO2/c1-7-6-13-10(11-7)8-4-2-3-5-9(8)12/h2-5,7,10-12H,6H2,1H3
InChIKeyRIOYJZYLNOFTLW-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.40
Rot. Bonds1

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

2-(4-methyl-1,3-oxazolidin-2-yl)phenol (PubChem CID 117228504) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-(4-methyl-1,3-oxazolidin-2-yl)phenol.

Molecular Properties

Compound Name2-(4-methyl-1,3-oxazolidin-2-yl)phenol
PubChem CID117228504
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name2-(4-methyl-1,3-oxazolidin-2-yl)phenol
SMILESCC1COC(c2ccccc2O)N1
InChIInChI=1S/C10H13NO2/c1-7-6-13-10(11-7)8-4-2-3-5-9(8)12/h2-5,7,10-12H,6H2,1H3
InChIKeyRIOYJZYLNOFTLW-UHFFFAOYSA-N
XLogP1.40
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.40
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-(5-methyl-1,3-dioxan-2-yl)phenol
CID 45117153
2-(1,3-oxazolidin-2-yl)phenol
CID 68731232
nickel;2-(oxaziridin-3-yl)phenol
CID 174498524
2-[(1S,2R)-2-methylcyclopropyl]phenol
CID 176896077
2-[3-(2-hydroxyphenyl)-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]phenol
CID 752691
4-methyl-2-pyridin-4-yl-1,3-oxazolidine;hydrochloride
CID 117228645
2-(oxaziridin-3-yl)phenol;trichlorochromium
CID 175156745
2-(oxiran-2-yl)phenol;phenol
CID 22174141
2-(5-methyl-2,3-dihydro-1,3,4-oxadiazol-2-yl)phenol
CID 146018572
2-(4-methylmorpholin-2-yl)phenol
CID 82278561
(2S,3S,5S,6R)-2,6-bis(2-hydroxyphenyl)-3,5-dimethylpiperidin-4-one
CID 6581730
2-[(4aR,8aS)-2,4,4a,5,8,8a-hexahydro-1H-3,1-benzoxazin-2-yl]-4-bromophenol
CID 14984744

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-1,3-oxazolidin-2-yl)phenol?
The IUPAC name of 2-(4-methyl-1,3-oxazolidin-2-yl)phenol (CID 117228504) is 2-(4-methyl-1,3-oxazolidin-2-yl)phenol.
What is the SMILES notation for 2-(4-methyl-1,3-oxazolidin-2-yl)phenol?
The canonical SMILES for 2-(4-methyl-1,3-oxazolidin-2-yl)phenol is CC1COC(c2ccccc2O)N1.
What is the InChIKey of 2-(4-methyl-1,3-oxazolidin-2-yl)phenol?
The InChIKey is RIOYJZYLNOFTLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-7-6-13-10(11-7)8-4-2-3-5-9(8)12/h2-5,7,10-12H,6H2,1H3.
What are the key properties of 2-(4-methyl-1,3-oxazolidin-2-yl)phenol?
2-(4-methyl-1,3-oxazolidin-2-yl)phenol has a molecular weight of 179.22 g/mol, XLogP of 1.40, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-1,3-oxazolidin-2-yl)phenol is sourced from PubChem (CID 117228504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).