4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine

C15H20N2O2 — CID 114877509

IUPAC4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine
SMILESCCC(C)Cc1onc(N)c1-c1ccccc1OC
InChIInChI=1S/C15H20N2O2/c1-4-10(2)9-13-14(15(16)17-19-13)11-7-5-6-8-12(11)18-3/h5-8,10H,4,9H2,1-3H3,(H2,16,17)
InChIKeyMKVVHJZOFMOYDA-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.52
Rot. Bonds5

About 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine

4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine (PubChem CID 114877509) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine
PubChem CID114877509
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine
SMILESCCC(C)Cc1onc(N)c1-c1ccccc1OC
InChIInChI=1S/C15H20N2O2/c1-4-10(2)9-13-14(15(16)17-19-13)11-7-5-6-8-12(11)18-3/h5-8,10H,4,9H2,1-3H3,(H2,16,17)
InChIKeyMKVVHJZOFMOYDA-UHFFFAOYSA-N
XLogP3.52
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 ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-methoxyphenyl)-5-(2,3,3-trimethylbutyl)-1,2-oxazol-3-amine
CID 66198768
5-butyl-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66200570
5-(2-methylbutyl)-4-pyridin-2-yl-1,2-oxazol-3-amine
CID 114877558
5-(2-methylbutyl)-4-(4-propan-2-ylphenyl)-1,2-oxazol-3-amine
CID 114877544
4-(2-methoxyphenyl)-3-(2-methylpropyl)-1,2-oxazol-5-amine
CID 43158239
4-(2-methoxyphenyl)-5-thiophen-2-yl-1,2-oxazol-3-amine
CID 66200367
5-(4-fluorophenyl)-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66198769
5-(5-fluoro-2-pyridinyl)-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 104643337
5-cyclohexyl-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66198368
5-(furan-3-yl)-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66199968
4-(2-methoxyphenyl)-5-pyridin-3-yl-1,2-oxazol-3-amine
CID 66198370
5-(3-fluorophenyl)-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66199764

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine (CID 114877509) is 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine is CCC(C)Cc1onc(N)c1-c1ccccc1OC.
What is the InChIKey of 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine?
The InChIKey is MKVVHJZOFMOYDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-10(2)9-13-14(15(16)17-19-13)11-7-5-6-8-12(11)18-3/h5-8,10H,4,9H2,1-3H3,(H2,16,17).
What are the key properties of 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine?
4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine has a molecular weight of 260.34 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-5-(2-methylbutyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 114877509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).