[2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol

C9H9N3O2 — CID 135232820

IUPAC[2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol
SMILESNc1cccc(-c2nc(CO)co2)n1
InChIInChI=1S/C9H9N3O2/c10-8-3-1-2-7(12-8)9-11-6(4-13)5-14-9/h1-3,5,13H,4H2,(H2,10,12)
InChIKeyDUQLOAFQCSLYFS-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.81
Rot. Bonds2

About [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol

[2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol (PubChem CID 135232820) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol
PubChem CID135232820
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name[2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol
SMILESNc1cccc(-c2nc(CO)co2)n1
InChIInChI=1S/C9H9N3O2/c10-8-3-1-2-7(12-8)9-11-6(4-13)5-14-9/h1-3,5,13H,4H2,(H2,10,12)
InChIKeyDUQLOAFQCSLYFS-UHFFFAOYSA-N
XLogP0.81
TPSA85.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol?
The IUPAC name of [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol (CID 135232820) is [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol is Nc1cccc(-c2nc(CO)co2)n1.
What is the InChIKey of [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol?
The InChIKey is DUQLOAFQCSLYFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c10-8-3-1-2-7(12-8)9-11-6(4-13)5-14-9/h1-3,5,13H,4H2,(H2,10,12).
What are the key properties of [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol?
[2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol has a molecular weight of 191.19 g/mol, XLogP of 0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(6-amino-2-pyridinyl)-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 135232820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).