(5-ethyl-1,2-oxazol-3-yl)methanamine

C6H10N2O — CID 23006259

IUPAC(5-ethyl-1,2-oxazol-3-yl)methanamine
SMILESCCc1cc(CN)no1
InChIInChI=1S/C6H10N2O/c1-2-6-3-5(4-7)8-9-6/h3H,2,4,7H2,1H3
InChIKeyBPTOWLOEDKFJRE-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.70
Rot. Bonds2

About (5-ethyl-1,2-oxazol-3-yl)methanamine

(5-ethyl-1,2-oxazol-3-yl)methanamine (PubChem CID 23006259) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is (5-ethyl-1,2-oxazol-3-yl)methanamine.

Molecular Properties

Compound Name(5-ethyl-1,2-oxazol-3-yl)methanamine
PubChem CID23006259
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name(5-ethyl-1,2-oxazol-3-yl)methanamine
SMILESCCc1cc(CN)no1
InChIInChI=1S/C6H10N2O/c1-2-6-3-5(4-7)8-9-6/h3H,2,4,7H2,1H3
InChIKeyBPTOWLOEDKFJRE-UHFFFAOYSA-N
XLogP0.70
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-ethyl-1,2-oxazol-3-yl)methanamine?
The IUPAC name of (5-ethyl-1,2-oxazol-3-yl)methanamine (CID 23006259) is (5-ethyl-1,2-oxazol-3-yl)methanamine.
What is the SMILES notation for (5-ethyl-1,2-oxazol-3-yl)methanamine?
The canonical SMILES for (5-ethyl-1,2-oxazol-3-yl)methanamine is CCc1cc(CN)no1.
What is the InChIKey of (5-ethyl-1,2-oxazol-3-yl)methanamine?
The InChIKey is BPTOWLOEDKFJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-6-3-5(4-7)8-9-6/h3H,2,4,7H2,1H3.
What are the key properties of (5-ethyl-1,2-oxazol-3-yl)methanamine?
(5-ethyl-1,2-oxazol-3-yl)methanamine has a molecular weight of 126.16 g/mol, XLogP of 0.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethyl-1,2-oxazol-3-yl)methanamine is sourced from PubChem (CID 23006259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).