2-amino-4-benzyl-1,3-oxazolidin-2-ol

C10H14N2O2 — CID 57458781

IUPAC2-amino-4-benzyl-1,3-oxazolidin-2-ol
SMILESNC1(O)NC(Cc2ccccc2)CO1
InChIInChI=1S/C10H14N2O2/c11-10(13)12-9(7-14-10)6-8-4-2-1-3-5-8/h1-5,9,12-13H,6-7,11H2
InChIKeyQGXGBMHTXWNCDS-UHFFFAOYSA-N
MW194.23 g/mol
LogP-0.22
Rot. Bonds2

About 2-amino-4-benzyl-1,3-oxazolidin-2-ol

2-amino-4-benzyl-1,3-oxazolidin-2-ol (PubChem CID 57458781) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-amino-4-benzyl-1,3-oxazolidin-2-ol.

Molecular Properties

Compound Name2-amino-4-benzyl-1,3-oxazolidin-2-ol
PubChem CID57458781
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-amino-4-benzyl-1,3-oxazolidin-2-ol
SMILESNC1(O)NC(Cc2ccccc2)CO1
InChIInChI=1S/C10H14N2O2/c11-10(13)12-9(7-14-10)6-8-4-2-1-3-5-8/h1-5,9,12-13H,6-7,11H2
InChIKeyQGXGBMHTXWNCDS-UHFFFAOYSA-N
XLogP-0.22
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-amino-4-benzyl-1,3-oxazolidin-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-benzyl-1,3-oxazolidin-2-ol?
The IUPAC name of 2-amino-4-benzyl-1,3-oxazolidin-2-ol (CID 57458781) is 2-amino-4-benzyl-1,3-oxazolidin-2-ol.
What is the SMILES notation for 2-amino-4-benzyl-1,3-oxazolidin-2-ol?
The canonical SMILES for 2-amino-4-benzyl-1,3-oxazolidin-2-ol is NC1(O)NC(Cc2ccccc2)CO1.
What is the InChIKey of 2-amino-4-benzyl-1,3-oxazolidin-2-ol?
The InChIKey is QGXGBMHTXWNCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c11-10(13)12-9(7-14-10)6-8-4-2-1-3-5-8/h1-5,9,12-13H,6-7,11H2.
What are the key properties of 2-amino-4-benzyl-1,3-oxazolidin-2-ol?
2-amino-4-benzyl-1,3-oxazolidin-2-ol has a molecular weight of 194.23 g/mol, XLogP of -0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-benzyl-1,3-oxazolidin-2-ol is sourced from PubChem (CID 57458781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).