2-methyl-3-phenyl-1,2-oxazolidin-5-ol

C10H13NO2 — CID 15693095

IUPAC2-methyl-3-phenyl-1,2-oxazolidin-5-ol
SMILESCN1OC(O)CC1c1ccccc1
InChIInChI=1S/C10H13NO2/c1-11-9(7-10(12)13-11)8-5-3-2-4-6-8/h2-6,9-10,12H,7H2,1H3
InChIKeyPNFJVXINRZNLBW-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.31
Rot. Bonds1

About 2-methyl-3-phenyl-1,2-oxazolidin-5-ol

2-methyl-3-phenyl-1,2-oxazolidin-5-ol (PubChem CID 15693095) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-methyl-3-phenyl-1,2-oxazolidin-5-ol.

Molecular Properties

Compound Name2-methyl-3-phenyl-1,2-oxazolidin-5-ol
PubChem CID15693095
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name2-methyl-3-phenyl-1,2-oxazolidin-5-ol
SMILESCN1OC(O)CC1c1ccccc1
InChIInChI=1S/C10H13NO2/c1-11-9(7-10(12)13-11)8-5-3-2-4-6-8/h2-6,9-10,12H,7H2,1H3
InChIKeyPNFJVXINRZNLBW-UHFFFAOYSA-N
XLogP1.31
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 ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R,5S)-2-methyl-3-phenyl-5-(trifluoromethyl)-1,2-oxazolidine
CID 15151212
4-(Difluoromethylidene)-2-methyl-3-phenyl-1,2-oxazolidine
CID 13582988
(3R,4S)-2-methyl-3-phenyl-4-(trifluoromethyl)-1,2-oxazolidine
CID 15151214
(3S,5S)-2-methyl-3-phenyl-5-(trifluoromethyl)-1,2-oxazolidine
CID 101639521
5-(Difluoromethylidene)-2-methyl-3-phenyl-1,2-oxazolidine
CID 134922281
(3r,5s)-5-Iodomethyl-2-methyl-3-phenyl-isoxazolidine
CID 11141200
(3R,5R)-5-(iodomethyl)-2-methyl-3-phenyl-1,2-oxazolidine
CID 5323941
[(3R,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]methanol
CID 6933895
(3R,5R)-2-methyl-3-phenyl-5-prop-2-enyl-1,2-oxazolidine
CID 10420426
(1R)-1-[(3R,5R)-2-methyl-3-phenyl-1,2-oxazolidin-5-yl]butan-1-ol
CID 10776132
(3S)-2-benzyl-3-phenyl-1,2-oxazolidine
CID 11413758
5-Methyl-6-phenyl-4-oxa-5-azaspiro[2.4]heptane
CID 13585889

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-phenyl-1,2-oxazolidin-5-ol?
The IUPAC name of 2-methyl-3-phenyl-1,2-oxazolidin-5-ol (CID 15693095) is 2-methyl-3-phenyl-1,2-oxazolidin-5-ol.
What is the SMILES notation for 2-methyl-3-phenyl-1,2-oxazolidin-5-ol?
The canonical SMILES for 2-methyl-3-phenyl-1,2-oxazolidin-5-ol is CN1OC(O)CC1c1ccccc1.
What is the InChIKey of 2-methyl-3-phenyl-1,2-oxazolidin-5-ol?
The InChIKey is PNFJVXINRZNLBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-11-9(7-10(12)13-11)8-5-3-2-4-6-8/h2-6,9-10,12H,7H2,1H3.
What are the key properties of 2-methyl-3-phenyl-1,2-oxazolidin-5-ol?
2-methyl-3-phenyl-1,2-oxazolidin-5-ol has a molecular weight of 179.22 g/mol, XLogP of 1.31, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-phenyl-1,2-oxazolidin-5-ol is sourced from PubChem (CID 15693095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).