(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole

C10H11NO — CID 123675513

IUPAC(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole
SMILESCC1=C[C@H](c2ccccc2)ON1
InChIInChI=1S/C10H11NO/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-7,10-11H,1H3/t10-/m1/s1
InChIKeyKTHOSGPDHKEOIW-SNVBAGLBSA-N
MW161.20 g/mol
LogP2.17
Rot. Bonds1

About (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole

(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole (PubChem CID 123675513) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole.

Molecular Properties

Compound Name(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole
PubChem CID123675513
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole
SMILESCC1=C[C@H](c2ccccc2)ON1
InChIInChI=1S/C10H11NO/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-7,10-11H,1H3/t10-/m1/s1
InChIKeyKTHOSGPDHKEOIW-SNVBAGLBSA-N
XLogP2.17
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole?
The IUPAC name of (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole (CID 123675513) is (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole.
What is the SMILES notation for (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole?
The canonical SMILES for (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole is CC1=C[C@H](c2ccccc2)ON1.
What is the InChIKey of (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole?
The InChIKey is KTHOSGPDHKEOIW-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H11NO/c1-8-7-10(12-11-8)9-5-3-2-4-6-9/h2-7,10-11H,1H3/t10-/m1/s1.
What are the key properties of (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole?
(5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole has a molecular weight of 161.20 g/mol, XLogP of 2.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-methyl-5-phenyl-2,5-dihydro-1,2-oxazole is sourced from PubChem (CID 123675513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).