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

C11H14N2O2 — CID 65178651

IUPAC3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine
SMILESCc1ccc(-c2cnc(CCCN)o2)o1
InChIInChI=1S/C11H14N2O2/c1-8-4-5-9(14-8)10-7-13-11(15-10)3-2-6-12/h4-5,7H,2-3,6,12H2,1H3
InChIKeyWPLFKTYNHHNASS-UHFFFAOYSA-N
MW206.25 g/mol
LogP2.13
Rot. Bonds4

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

3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine (PubChem CID 65178651) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine.

Molecular Properties

Compound Name3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine
PubChem CID65178651
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine
SMILESCc1ccc(-c2cnc(CCCN)o2)o1
InChIInChI=1S/C11H14N2O2/c1-8-4-5-9(14-8)10-7-13-11(15-10)3-2-6-12/h4-5,7H,2-3,6,12H2,1H3
InChIKeyWPLFKTYNHHNASS-UHFFFAOYSA-N
XLogP2.13
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine?
The IUPAC name of 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine (CID 65178651) is 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine.
What is the SMILES notation for 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine?
The canonical SMILES for 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine is Cc1ccc(-c2cnc(CCCN)o2)o1.
What is the InChIKey of 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine?
The InChIKey is WPLFKTYNHHNASS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-8-4-5-9(14-8)10-7-13-11(15-10)3-2-6-12/h4-5,7H,2-3,6,12H2,1H3.
What are the key properties of 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine?
3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine has a molecular weight of 206.25 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(5-methylfuran-2-yl)-1,3-oxazol-2-yl]propan-1-amine is sourced from PubChem (CID 65178651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).