5-methyl-3-phenyl-1,2-oxazol-4-amine

C10H10N2O — CID 2747584

IUPAC5-methyl-3-phenyl-1,2-oxazol-4-amine
SMILESCc1onc(-c2ccccc2)c1N
InChIInChI=1S/C10H10N2O/c1-7-9(11)10(12-13-7)8-5-3-2-4-6-8/h2-6H,11H2,1H3
InChIKeyQWMOVJWPTZATFS-UHFFFAOYSA-N
MW174.20 g/mol
LogP2.23
Rot. Bonds1

About 5-methyl-3-phenyl-1,2-oxazol-4-amine

5-methyl-3-phenyl-1,2-oxazol-4-amine (PubChem CID 2747584) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 5-methyl-3-phenyl-1,2-oxazol-4-amine.

Molecular Properties

Compound Name5-methyl-3-phenyl-1,2-oxazol-4-amine
PubChem CID2747584
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name5-methyl-3-phenyl-1,2-oxazol-4-amine
SMILESCc1onc(-c2ccccc2)c1N
InChIInChI=1S/C10H10N2O/c1-7-9(11)10(12-13-7)8-5-3-2-4-6-8/h2-6H,11H2,1H3
InChIKeyQWMOVJWPTZATFS-UHFFFAOYSA-N
XLogP2.23
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-phenyl-1,2-oxazol-4-amine?
The IUPAC name of 5-methyl-3-phenyl-1,2-oxazol-4-amine (CID 2747584) is 5-methyl-3-phenyl-1,2-oxazol-4-amine.
What is the SMILES notation for 5-methyl-3-phenyl-1,2-oxazol-4-amine?
The canonical SMILES for 5-methyl-3-phenyl-1,2-oxazol-4-amine is Cc1onc(-c2ccccc2)c1N.
What is the InChIKey of 5-methyl-3-phenyl-1,2-oxazol-4-amine?
The InChIKey is QWMOVJWPTZATFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-9(11)10(12-13-7)8-5-3-2-4-6-8/h2-6H,11H2,1H3.
What are the key properties of 5-methyl-3-phenyl-1,2-oxazol-4-amine?
5-methyl-3-phenyl-1,2-oxazol-4-amine has a molecular weight of 174.20 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-phenyl-1,2-oxazol-4-amine is sourced from PubChem (CID 2747584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).