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

C13H19NO2 — CID 12566198

IUPAC(2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol
SMILESCC(C)N1CC(CO)OC1c1ccccc1
InChIInChI=1S/C13H19NO2/c1-10(2)14-8-12(9-15)16-13(14)11-6-4-3-5-7-11/h3-7,10,12-13,15H,8-9H2,1-2H3
InChIKeyHNOAXSVPMXZKBT-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.79
Rot. Bonds3

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

(2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol (PubChem CID 12566198) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol.

Molecular Properties

Compound Name(2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol
PubChem CID12566198
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name(2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol
SMILESCC(C)N1CC(CO)OC1c1ccccc1
InChIInChI=1S/C13H19NO2/c1-10(2)14-8-12(9-15)16-13(14)11-6-4-3-5-7-11/h3-7,10,12-13,15H,8-9H2,1-2H3
InChIKeyHNOAXSVPMXZKBT-UHFFFAOYSA-N
XLogP1.79
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(Benzyloxy)-3-(2,6-dimethyl-1-piperidinyl)-2-propanol hydrochloride
CID 16236854
1-(2-Methylpiperidin-1-yl)-3-phenylmethoxypropan-2-ol;hydrochloride
CID 16238906
1-Benzyloxy-3-pyrrolidin-1-yl-propan-2-ol
CID 2881951
3-Methyl-2-phenyl-1,3-oxazolidine
CID 98113
(2R,3R,4S)-2-[[[(1R)-1-phenyl-2-phenylmethoxyethyl]amino]methyl]pyrrolidine-3,4-diol
CID 11416597
1-[Benzyl(ethyl)amino]-3-phenylmethoxypropan-2-ol
CID 44427649
3-(1,1-Dimethylethyl)-2-phenyloxazolidine-5-methanol
CID 108810
2,3-Dimethyl-2-phenyl-1,3-oxazolidine
CID 388442
3,4-Dimethyl-2,5-diphenyl-1,3-oxazolidine
CID 434347
2-Propanol, 1-(diethylamino)-3-(phenylmethoxy)-
CID 201044
3-Methyl-2-(4-methylphenyl)-1,3-oxazolidine
CID 3051660
2,2,3-Trimethyl-5-phenyl-1,3-oxazolidine
CID 3064887

Frequently Asked Questions

What is the IUPAC name of (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
The IUPAC name of (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol (CID 12566198) is (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol.
What is the SMILES notation for (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
The canonical SMILES for (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol is CC(C)N1CC(CO)OC1c1ccccc1.
What is the InChIKey of (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
The InChIKey is HNOAXSVPMXZKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-10(2)14-8-12(9-15)16-13(14)11-6-4-3-5-7-11/h3-7,10,12-13,15H,8-9H2,1-2H3.
What are the key properties of (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol?
(2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol has a molecular weight of 221.30 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyl-3-propan-2-yl-1,3-oxazolidin-5-yl)methanol is sourced from PubChem (CID 12566198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).