2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine

C10H16N2O2 — CID 65178753

IUPAC2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine
SMILESNCCc1ncc(CC2CCCO2)o1
InChIInChI=1S/C10H16N2O2/c11-4-3-10-12-7-9(14-10)6-8-2-1-5-13-8/h7-8H,1-6,11H2
InChIKeyHWWSTXFULZKSCV-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.90
Rot. Bonds4

About 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine

2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine (PubChem CID 65178753) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine.

Molecular Properties

Compound Name2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine
PubChem CID65178753
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine
SMILESNCCc1ncc(CC2CCCO2)o1
InChIInChI=1S/C10H16N2O2/c11-4-3-10-12-7-9(14-10)6-8-2-1-5-13-8/h7-8H,1-6,11H2
InChIKeyHWWSTXFULZKSCV-UHFFFAOYSA-N
XLogP0.90
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine?
The IUPAC name of 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine (CID 65178753) is 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine.
What is the SMILES notation for 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine?
The canonical SMILES for 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine is NCCc1ncc(CC2CCCO2)o1.
What is the InChIKey of 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine?
The InChIKey is HWWSTXFULZKSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c11-4-3-10-12-7-9(14-10)6-8-2-1-5-13-8/h7-8H,1-6,11H2.
What are the key properties of 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine?
2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine has a molecular weight of 196.25 g/mol, XLogP of 0.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(oxolan-2-ylmethyl)-1,3-oxazol-2-yl]ethanamine is sourced from PubChem (CID 65178753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).