5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine

C15H20N2O2 — CID 117405267

IUPAC5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine
SMILESCCC(CC)c1ccc(OC)c(-c2cc(N)no2)c1
InChIInChI=1S/C15H20N2O2/c1-4-10(5-2)11-6-7-13(18-3)12(8-11)14-9-15(16)17-19-14/h6-10H,4-5H2,1-3H3,(H2,16,17)
InChIKeyNXTRFZCTAQDRNR-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.84
Rot. Bonds5

About 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine

5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine (PubChem CID 117405267) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine
PubChem CID117405267
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine
SMILESCCC(CC)c1ccc(OC)c(-c2cc(N)no2)c1
InChIInChI=1S/C15H20N2O2/c1-4-10(5-2)11-6-7-13(18-3)12(8-11)14-9-15(16)17-19-14/h6-10H,4-5H2,1-3H3,(H2,16,17)
InChIKeyNXTRFZCTAQDRNR-UHFFFAOYSA-N
XLogP3.84
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-pentan-3-ylphenyl)-1,2-oxazol-3-amine
CID 117332870
5-(5-ethoxy-2-methoxy-4-methylphenyl)-1,2-oxazol-3-amine
CID 117373528
2-[5-(2-methoxy-5-propan-2-ylphenyl)-1,2-oxazol-3-yl]ethanamine
CID 96665567
5-(3-chloro-2,4-dimethoxyphenyl)-1,2-oxazol-3-amine
CID 117389690
5-(2,5-dimethoxy-4-propan-2-yloxyphenyl)-1,2-oxazol-3-amine
CID 117446006
5-(3-chloro-4-methoxyphenyl)-1,2-oxazol-3-amine
CID 82114977
2-(3-amino-1,2-oxazol-5-yl)-6-methoxy-3-methylphenol
CID 136993784
3-(3-amino-1,2-oxazol-5-yl)-2-fluoro-6-methoxyphenol
CID 117321250
5-(7-methoxy-1-benzofuran-4-yl)-1,2-oxazol-3-amine
CID 117332191
2-(2-methoxy-5-pentan-3-ylphenyl)propan-2-amine
CID 117343688
5-(5-bromo-4-methoxy-2-methylphenyl)-1,2-oxazol-3-amine
CID 117454912
5-(4-methoxy-3-methylphenyl)-1,2-oxazol-3-amine
CID 82112667

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine (CID 117405267) is 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine is CCC(CC)c1ccc(OC)c(-c2cc(N)no2)c1.
What is the InChIKey of 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine?
The InChIKey is NXTRFZCTAQDRNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-10(5-2)11-6-7-13(18-3)12(8-11)14-9-15(16)17-19-14/h6-10H,4-5H2,1-3H3,(H2,16,17).
What are the key properties of 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine?
5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine has a molecular weight of 260.34 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-5-pentan-3-ylphenyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 117405267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).