5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine

C15H14N2O2 — CID 66198915

IUPAC5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine
SMILESNc1noc(CCc2ccco2)c1-c1ccccc1
InChIInChI=1S/C15H14N2O2/c16-15-14(11-5-2-1-3-6-11)13(19-17-15)9-8-12-7-4-10-18-12/h1-7,10H,8-9H2,(H2,16,17)
InChIKeyZTKPPINNZZNYBX-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.30
Rot. Bonds4

About 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine

5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine (PubChem CID 66198915) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine
PubChem CID66198915
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine
SMILESNc1noc(CCc2ccco2)c1-c1ccccc1
InChIInChI=1S/C15H14N2O2/c16-15-14(11-5-2-1-3-6-11)13(19-17-15)9-8-12-7-4-10-18-12/h1-7,10H,8-9H2,(H2,16,17)
InChIKeyZTKPPINNZZNYBX-UHFFFAOYSA-N
XLogP3.30
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine?
The IUPAC name of 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine (CID 66198915) is 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine.
What is the SMILES notation for 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine?
The canonical SMILES for 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine is Nc1noc(CCc2ccco2)c1-c1ccccc1.
What is the InChIKey of 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine?
The InChIKey is ZTKPPINNZZNYBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c16-15-14(11-5-2-1-3-6-11)13(19-17-15)9-8-12-7-4-10-18-12/h1-7,10H,8-9H2,(H2,16,17).
What are the key properties of 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine?
5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine has a molecular weight of 254.29 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(furan-2-yl)ethyl]-4-phenyl-1,2-oxazol-3-amine is sourced from PubChem (CID 66198915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).