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

C6H10N2O — CID 82418815

IUPAC(4-ethyl-1,3-oxazol-5-yl)methanamine
SMILESCCc1ncoc1CN
InChIInChI=1S/C6H10N2O/c1-2-5-6(3-7)9-4-8-5/h4H,2-3,7H2,1H3
InChIKeyCWBBWPSWZGRMMV-UHFFFAOYSA-N
MW126.16 g/mol
LogP0.70
Rot. Bonds2

About (4-ethyl-1,3-oxazol-5-yl)methanamine

(4-ethyl-1,3-oxazol-5-yl)methanamine (PubChem CID 82418815) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is (4-ethyl-1,3-oxazol-5-yl)methanamine.

Molecular Properties

Compound Name(4-ethyl-1,3-oxazol-5-yl)methanamine
PubChem CID82418815
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name(4-ethyl-1,3-oxazol-5-yl)methanamine
SMILESCCc1ncoc1CN
InChIInChI=1S/C6H10N2O/c1-2-5-6(3-7)9-4-8-5/h4H,2-3,7H2,1H3
InChIKeyCWBBWPSWZGRMMV-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 (4-ethyl-1,3-oxazol-5-yl)methanamine?
The IUPAC name of (4-ethyl-1,3-oxazol-5-yl)methanamine (CID 82418815) is (4-ethyl-1,3-oxazol-5-yl)methanamine.
What is the SMILES notation for (4-ethyl-1,3-oxazol-5-yl)methanamine?
The canonical SMILES for (4-ethyl-1,3-oxazol-5-yl)methanamine is CCc1ncoc1CN.
What is the InChIKey of (4-ethyl-1,3-oxazol-5-yl)methanamine?
The InChIKey is CWBBWPSWZGRMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-2-5-6(3-7)9-4-8-5/h4H,2-3,7H2,1H3.
What are the key properties of (4-ethyl-1,3-oxazol-5-yl)methanamine?
(4-ethyl-1,3-oxazol-5-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 (4-ethyl-1,3-oxazol-5-yl)methanamine is sourced from PubChem (CID 82418815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).