[4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol

C6H13NO3 — CID 55299662

IUPAC[4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol
SMILESCC1NC(CO)(CO)CO1
InChIInChI=1S/C6H13NO3/c1-5-7-6(2-8,3-9)4-10-5/h5,7-9H,2-4H2,1H3
InChIKeyTYYRMNXKFIKCNU-UHFFFAOYSA-N
MW147.17 g/mol
LogP-1.32
Rot. Bonds2

About [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol

[4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol (PubChem CID 55299662) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol.

Molecular Properties

Compound Name[4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol
PubChem CID55299662
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Name[4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol
SMILESCC1NC(CO)(CO)CO1
InChIInChI=1S/C6H13NO3/c1-5-7-6(2-8,3-9)4-10-5/h5,7-9H,2-4H2,1H3
InChIKeyTYYRMNXKFIKCNU-UHFFFAOYSA-N
XLogP-1.32
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 5-1.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol?
The IUPAC name of [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol (CID 55299662) is [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol.
What is the SMILES notation for [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol?
The canonical SMILES for [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol is CC1NC(CO)(CO)CO1.
What is the InChIKey of [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol?
The InChIKey is TYYRMNXKFIKCNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-5-7-6(2-8,3-9)4-10-5/h5,7-9H,2-4H2,1H3.
What are the key properties of [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol?
[4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol has a molecular weight of 147.17 g/mol, XLogP of -1.32, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(hydroxymethyl)-2-methyl-1,3-oxazolidin-4-yl]methanol is sourced from PubChem (CID 55299662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).