4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine

C15H20N2O2 — CID 117405284

IUPAC4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine
SMILESCCc1ccc(C(C)C)c(-c2cnoc2N)c1OC
InChIInChI=1S/C15H20N2O2/c1-5-10-6-7-11(9(2)3)13(14(10)18-4)12-8-17-19-15(12)16/h6-9H,5,16H2,1-4H3
InChIKeyWPNIRHKENPNGSG-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.62
Rot. Bonds4

About 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine

4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine (PubChem CID 117405284) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine
PubChem CID117405284
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine
SMILESCCc1ccc(C(C)C)c(-c2cnoc2N)c1OC
InChIInChI=1S/C15H20N2O2/c1-5-10-6-7-11(9(2)3)13(14(10)18-4)12-8-17-19-15(12)16/h6-9H,5,16H2,1-4H3
InChIKeyWPNIRHKENPNGSG-UHFFFAOYSA-N
XLogP3.62
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine (CID 117405284) is 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine is CCc1ccc(C(C)C)c(-c2cnoc2N)c1OC.
What is the InChIKey of 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine?
The InChIKey is WPNIRHKENPNGSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-5-10-6-7-11(9(2)3)13(14(10)18-4)12-8-17-19-15(12)16/h6-9H,5,16H2,1-4H3.
What are the key properties of 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine?
4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine has a molecular weight of 260.34 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethyl-2-methoxy-6-propan-2-ylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 117405284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).