(5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one

C9H10N2O3 — CID 115056906

IUPAC(5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one
SMILESO=C1O[C@@H](CO)CN1c1ccncc1
InChIInChI=1S/C9H10N2O3/c12-6-8-5-11(9(13)14-8)7-1-3-10-4-2-7/h1-4,8,12H,5-6H2/t8-/m1/s1
InChIKeyMVSSQOQFTQKQDC-MRVPVSSYSA-N
MW194.19 g/mol
LogP0.40
Rot. Bonds2

About (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one

(5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one (PubChem CID 115056906) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one
PubChem CID115056906
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name(5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one
SMILESO=C1O[C@@H](CO)CN1c1ccncc1
InChIInChI=1S/C9H10N2O3/c12-6-8-5-11(9(13)14-8)7-1-3-10-4-2-7/h1-4,8,12H,5-6H2/t8-/m1/s1
InChIKeyMVSSQOQFTQKQDC-MRVPVSSYSA-N
XLogP0.40
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[5-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]benzoic acid
CID 117063705
5-(hydroxymethyl)-3-(4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one
CID 22014481
(5R)-3-(4-acetylphenyl)-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 15591327
(5R)-5-(hydroxymethyl)-3-(4-nitrophenyl)-1,3-oxazolidin-2-one
CID 58777713
5-(hydroxymethyl)-3-(4-methylsulfinylphenyl)-1,3-oxazolidin-2-one
CID 13038088
5-(hydroxymethyl)-3-[4-(methoxyamino)phenyl]-1,3-oxazolidin-2-one
CID 143663891
5-(hydroxymethyl)-3-naphthalen-2-yl-1,3-oxazolidin-2-one
CID 19012505
1-[4-[5-(hydroxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]cyclopropane-1-carbonitrile
CID 23441457
(5S)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 66736976
[2-oxo-3-(4-pyridin-4-ylphenyl)-1,3-oxazolidin-5-yl]methylthiourea
CID 85054920
5-(hydroxymethyl)-3-(2-hydroxyphenyl)-1,3-oxazolidin-2-one
CID 19773689
(5S)-3-[4-(2-azidoethyl)phenyl]-5-(hydroxymethyl)-1,3-oxazolidin-2-one
CID 59667582

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one?
The IUPAC name of (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one (CID 115056906) is (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one?
The canonical SMILES for (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one is O=C1O[C@@H](CO)CN1c1ccncc1.
What is the InChIKey of (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one?
The InChIKey is MVSSQOQFTQKQDC-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H10N2O3/c12-6-8-5-11(9(13)14-8)7-1-3-10-4-2-7/h1-4,8,12H,5-6H2/t8-/m1/s1.
What are the key properties of (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one?
(5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one has a molecular weight of 194.19 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(hydroxymethyl)-3-pyridin-4-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 115056906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).