2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine

C10H16N2O2 — CID 115084963

IUPAC2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine
SMILESCC(CN)c1cnc(C2CCOC2)o1
InChIInChI=1S/C10H16N2O2/c1-7(4-11)9-5-12-10(14-9)8-2-3-13-6-8/h5,7-8H,2-4,6,11H2,1H3
InChIKeyBWRYKTRRYBSVTM-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.24
Rot. Bonds3

About 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine

2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine (PubChem CID 115084963) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine.

Molecular Properties

Compound Name2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine
PubChem CID115084963
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine
SMILESCC(CN)c1cnc(C2CCOC2)o1
InChIInChI=1S/C10H16N2O2/c1-7(4-11)9-5-12-10(14-9)8-2-3-13-6-8/h5,7-8H,2-4,6,11H2,1H3
InChIKeyBWRYKTRRYBSVTM-UHFFFAOYSA-N
XLogP1.24
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine?
The IUPAC name of 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine (CID 115084963) is 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine.
What is the SMILES notation for 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine?
The canonical SMILES for 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine is CC(CN)c1cnc(C2CCOC2)o1.
What is the InChIKey of 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine?
The InChIKey is BWRYKTRRYBSVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(4-11)9-5-12-10(14-9)8-2-3-13-6-8/h5,7-8H,2-4,6,11H2,1H3.
What are the key properties of 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine?
2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine has a molecular weight of 196.25 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxolan-3-yl)-1,3-oxazol-5-yl]propan-1-amine is sourced from PubChem (CID 115084963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).