1-amino-1-(1,2-oxazol-3-yl)propan-2-ol

C6H10N2O2 — CID 82417981

IUPAC1-amino-1-(1,2-oxazol-3-yl)propan-2-ol
SMILESCC(O)C(N)c1ccon1
InChIInChI=1S/C6H10N2O2/c1-4(9)6(7)5-2-3-10-8-5/h2-4,6,9H,7H2,1H3
InChIKeyJXFJOFGUSLTLCO-UHFFFAOYSA-N
MW142.16 g/mol
LogP0.06
Rot. Bonds2

About 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol

1-amino-1-(1,2-oxazol-3-yl)propan-2-ol (PubChem CID 82417981) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-1-(1,2-oxazol-3-yl)propan-2-ol
PubChem CID82417981
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name1-amino-1-(1,2-oxazol-3-yl)propan-2-ol
SMILESCC(O)C(N)c1ccon1
InChIInChI=1S/C6H10N2O2/c1-4(9)6(7)5-2-3-10-8-5/h2-4,6,9H,7H2,1H3
InChIKeyJXFJOFGUSLTLCO-UHFFFAOYSA-N
XLogP0.06
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-(1,2-oxazol-3-yl)ethanol
CID 82593730
(1R)-2,2,2-trifluoro-1-(1,2-oxazol-3-yl)ethanamine
CID 172639106
3-(1-cyclohexylethyl)-1,2-oxazole
CID 140506434
1-amino-1-(5-amino-2-pyridinyl)propan-2-ol
CID 55292549
3,3-difluoro-2-(1,2-oxazol-3-yl)propan-1-amine;hydrochloride
CID 171340437
(1S,2R)-1-amino-1-(6-amino-2-pyridinyl)propan-2-ol
CID 130815832
(1S,2S)-1-amino-1-(6-chloro-2-pyridinyl)propan-2-ol
CID 55271430
4,4,4-trifluoro-1-(1,2-oxazol-3-yl)butan-1-amine
CID 162614404
(1S,2R)-1-amino-1-(3-amino-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 104965505
(1R,2S)-1-amino-1-(2-methyl-1,3-thiazol-4-yl)propan-2-ol
CID 124505318
[1,2-oxazol-3-yl(sulfanyl)methyl] carbamate
CID 88739789
1-amino-1-(2-methyl-1,3-thiazol-4-yl)propan-2-ol;dihydrochloride
CID 122156676

Frequently Asked Questions

What is the IUPAC name of 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol?
The IUPAC name of 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol (CID 82417981) is 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol.
What is the SMILES notation for 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol?
The canonical SMILES for 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol is CC(O)C(N)c1ccon1.
What is the InChIKey of 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol?
The InChIKey is JXFJOFGUSLTLCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-4(9)6(7)5-2-3-10-8-5/h2-4,6,9H,7H2,1H3.
What are the key properties of 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol?
1-amino-1-(1,2-oxazol-3-yl)propan-2-ol has a molecular weight of 142.16 g/mol, XLogP of 0.06, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-1-(1,2-oxazol-3-yl)propan-2-ol is sourced from PubChem (CID 82417981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).