(3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol

C11H23NO2 — CID 21407812

IUPAC(3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol
SMILESCC(C)C1OC(CO)CN1C(C)(C)C
InChIInChI=1S/C11H23NO2/c1-8(2)10-12(11(3,4)5)6-9(7-13)14-10/h8-10,13H,6-7H2,1-5H3
InChIKeyAZQUEUBOHAZMEG-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.46
Rot. Bonds2

About (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol

(3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol (PubChem CID 21407812) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol.

Molecular Properties

Compound Name(3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol
PubChem CID21407812
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name(3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol
SMILESCC(C)C1OC(CO)CN1C(C)(C)C
InChIInChI=1S/C11H23NO2/c1-8(2)10-12(11(3,4)5)6-9(7-13)14-10/h8-10,13H,6-7H2,1-5H3
InChIKeyAZQUEUBOHAZMEG-UHFFFAOYSA-N
XLogP1.46
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

alpha-((2-Methylpropoxy)methyl)pyrrolidine-1-ethanol
CID 6452140
(S)-3-(1,1-Dimethylethyl)oxazolidine-5-methanol
CID 121778
[(5S)-3-tert-butyl-1,3-oxazolidin-5-yl]methanol
CID 21120093
1-(5-Methyl-2-propan-2-yl-1,3-oxazolidin-3-yl)propan-2-ol
CID 15176785
1-(2,3-Dimethyl-1,3-oxazolidin-2-yl)ethanol
CID 20507418
[2,3-Dimethyl-2-(2-methylpropyl)-1,3-oxazolidin-5-yl]methanol
CID 20583766
5-Oxazolidinemethanol, 2,3-dimethyl-2-(1-methylethyl)-
CID 20583767
3-Isopropyl-5-hydroxymethyloxazolidine
CID 21321287
(2-Methyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol
CID 21329346
3-(3-Methoxy-2-hydroxypropyl)-2-isopropyl-1,3-oxazolidine
CID 21559385
2-[(5S)-5-(hydroxymethyl)-1,3-oxazolidin-3-yl]-2-methylpropan-1-ol
CID 22799476
1-[2-(2,2-Dimethyl-1,3-oxazolidin-3-yl)ethoxy]butan-2-ol
CID 23528945

Frequently Asked Questions

What is the IUPAC name of (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
The IUPAC name of (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol (CID 21407812) is (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol.
What is the SMILES notation for (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
The canonical SMILES for (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol is CC(C)C1OC(CO)CN1C(C)(C)C.
What is the InChIKey of (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
The InChIKey is AZQUEUBOHAZMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-8(2)10-12(11(3,4)5)6-9(7-13)14-10/h8-10,13H,6-7H2,1-5H3.
What are the key properties of (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
(3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol has a molecular weight of 201.31 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-tert-butyl-2-propan-2-yl-1,3-oxazolidin-5-yl)methanol is sourced from PubChem (CID 21407812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).