2-(1,2-oxazol-3-ylamino)ethanol

C5H8N2O2 — CID 66605980

IUPAC2-(1,2-oxazol-3-ylamino)ethanol
SMILESOCCNc1ccon1
InChIInChI=1S/C5H8N2O2/c8-3-2-6-5-1-4-9-7-5/h1,4,8H,2-3H2,(H,6,7)
InChIKeyZLWMDQHSVQLAKP-UHFFFAOYSA-N
MW128.13 g/mol
LogP0.08
Rot. Bonds3

About 2-(1,2-oxazol-3-ylamino)ethanol

2-(1,2-oxazol-3-ylamino)ethanol (PubChem CID 66605980) has the molecular formula C5H8N2O2 and a molecular weight of 128.13 g/mol. Its IUPAC name is 2-(1,2-oxazol-3-ylamino)ethanol.

Molecular Properties

Compound Name2-(1,2-oxazol-3-ylamino)ethanol
PubChem CID66605980
Molecular FormulaC5H8N2O2
Molecular Weight128.13 g/mol
Exact Mass128.06
IUPAC Name2-(1,2-oxazol-3-ylamino)ethanol
SMILESOCCNc1ccon1
InChIInChI=1S/C5H8N2O2/c8-3-2-6-5-1-4-9-7-5/h1,4,8H,2-3H2,(H,6,7)
InChIKeyZLWMDQHSVQLAKP-UHFFFAOYSA-N
XLogP0.08
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-Butyl-3-(1,2-oxazol-3-yl)urea
CID 2093645
N-(2-methylpropyl)-1,2-oxazol-3-amine
CID 59531410
N-butyl-1,2-oxazol-3-amine
CID 73354023
N-methyl-1,2-oxazol-3-amine hydrochloride
CID 71306265
N-Methyl-1,2-oxazol-3-amine
CID 20299909
Pyrrolidinyl isoxazole
CID 21839252
Allylisoxazolylamine
CID 21992937
Isoxazolylalanine
CID 54538682
Isoxazolyl-serine
CID 69858242
N-(1-fluoroprop-2-enyl)-1,2-oxazol-3-amine
CID 70384647
N-(3-fluoroprop-2-enyl)-1,2-oxazol-3-amine
CID 70384651
N-(1,2-oxazol-3-yl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 79261787

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-oxazol-3-ylamino)ethanol?
The IUPAC name of 2-(1,2-oxazol-3-ylamino)ethanol (CID 66605980) is 2-(1,2-oxazol-3-ylamino)ethanol.
What is the SMILES notation for 2-(1,2-oxazol-3-ylamino)ethanol?
The canonical SMILES for 2-(1,2-oxazol-3-ylamino)ethanol is OCCNc1ccon1.
What is the InChIKey of 2-(1,2-oxazol-3-ylamino)ethanol?
The InChIKey is ZLWMDQHSVQLAKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O2/c8-3-2-6-5-1-4-9-7-5/h1,4,8H,2-3H2,(H,6,7).
What are the key properties of 2-(1,2-oxazol-3-ylamino)ethanol?
2-(1,2-oxazol-3-ylamino)ethanol has a molecular weight of 128.13 g/mol, XLogP of 0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-oxazol-3-ylamino)ethanol is sourced from PubChem (CID 66605980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).