3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine

C15H14N2O2 — CID 62828557

IUPAC3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
SMILESCc1cccc(-c2c(-c3ccoc3C)noc2N)c1
InChIInChI=1S/C15H14N2O2/c1-9-4-3-5-11(8-9)13-14(17-19-15(13)16)12-6-7-18-10(12)2/h3-8H,16H2,1-2H3
InChIKeyRDFSWLYIAGWHHM-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.80
Rot. Bonds2

About 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine

3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine (PubChem CID 62828557) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
PubChem CID62828557
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
SMILESCc1cccc(-c2c(-c3ccoc3C)noc2N)c1
InChIInChI=1S/C15H14N2O2/c1-9-4-3-5-11(8-9)13-14(17-19-15(13)16)12-6-7-18-10(12)2/h3-8H,16H2,1-2H3
InChIKeyRDFSWLYIAGWHHM-UHFFFAOYSA-N
XLogP3.80
TPSA65.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine (CID 62828557) is 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine is Cc1cccc(-c2c(-c3ccoc3C)noc2N)c1.
What is the InChIKey of 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
The InChIKey is RDFSWLYIAGWHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-9-4-3-5-11(8-9)13-14(17-19-15(13)16)12-6-7-18-10(12)2/h3-8H,16H2,1-2H3.
What are the key properties of 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine?
3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine has a molecular weight of 254.29 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 62828557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).