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

C15H14N2O2 — CID 66198480

IUPAC5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
SMILESCc1cccc(-c2c(N)noc2-c2ccoc2C)c1
InChIInChI=1S/C15H14N2O2/c1-9-4-3-5-11(8-9)13-14(19-17-15(13)16)12-6-7-18-10(12)2/h3-8H,1-2H3,(H2,16,17)
InChIKeyMMIPGZYEKGGCGS-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.80
Rot. Bonds2

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

5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine (PubChem CID 66198480) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
PubChem CID66198480
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC Name5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
SMILESCc1cccc(-c2c(N)noc2-c2ccoc2C)c1
InChIInChI=1S/C15H14N2O2/c1-9-4-3-5-11(8-9)13-14(19-17-15(13)16)12-6-7-18-10(12)2/h3-8H,1-2H3,(H2,16,17)
InChIKeyMMIPGZYEKGGCGS-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 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine (CID 66198480) is 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine is Cc1cccc(-c2c(N)noc2-c2ccoc2C)c1.
What is the InChIKey of 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine?
The InChIKey is MMIPGZYEKGGCGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-9-4-3-5-11(8-9)13-14(19-17-15(13)16)12-6-7-18-10(12)2/h3-8H,1-2H3,(H2,16,17).
What are the key properties of 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine?
5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-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 5-(2-methylfuran-3-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66198480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).