(3,5-diethyl-1,2-oxazol-4-yl)methanamine

C8H14N2O — CID 71755768

IUPAC(3,5-diethyl-1,2-oxazol-4-yl)methanamine
SMILESCCc1noc(CC)c1CN
InChIInChI=1S/C8H14N2O/c1-3-7-6(5-9)8(4-2)11-10-7/h3-5,9H2,1-2H3
InChIKeyWTCICVGKGDKXTI-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.26
Rot. Bonds3

About (3,5-diethyl-1,2-oxazol-4-yl)methanamine

(3,5-diethyl-1,2-oxazol-4-yl)methanamine (PubChem CID 71755768) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is (3,5-diethyl-1,2-oxazol-4-yl)methanamine.

Molecular Properties

Compound Name(3,5-diethyl-1,2-oxazol-4-yl)methanamine
PubChem CID71755768
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name(3,5-diethyl-1,2-oxazol-4-yl)methanamine
SMILESCCc1noc(CC)c1CN
InChIInChI=1S/C8H14N2O/c1-3-7-6(5-9)8(4-2)11-10-7/h3-5,9H2,1-2H3
InChIKeyWTCICVGKGDKXTI-UHFFFAOYSA-N
XLogP1.26
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3,5-diethyl-1,2-oxazol-4-yl)methanamine?
The IUPAC name of (3,5-diethyl-1,2-oxazol-4-yl)methanamine (CID 71755768) is (3,5-diethyl-1,2-oxazol-4-yl)methanamine.
What is the SMILES notation for (3,5-diethyl-1,2-oxazol-4-yl)methanamine?
The canonical SMILES for (3,5-diethyl-1,2-oxazol-4-yl)methanamine is CCc1noc(CC)c1CN.
What is the InChIKey of (3,5-diethyl-1,2-oxazol-4-yl)methanamine?
The InChIKey is WTCICVGKGDKXTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-3-7-6(5-9)8(4-2)11-10-7/h3-5,9H2,1-2H3.
What are the key properties of (3,5-diethyl-1,2-oxazol-4-yl)methanamine?
(3,5-diethyl-1,2-oxazol-4-yl)methanamine has a molecular weight of 154.21 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-diethyl-1,2-oxazol-4-yl)methanamine is sourced from PubChem (CID 71755768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).