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

C15H20N2O2 — CID 61262192

IUPAC4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine
SMILESCCC(CC)c1noc(N)c1-c1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-10(5-2)14-13(15(16)19-17-14)11-7-6-8-12(9-11)18-3/h6-10H,4-5,16H2,1-3H3
InChIKeyFCXSHJMVQSYOSS-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.84
Rot. Bonds5

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

4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine (PubChem CID 61262192) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine
PubChem CID61262192
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine
SMILESCCC(CC)c1noc(N)c1-c1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-10(5-2)14-13(15(16)19-17-14)11-7-6-8-12(9-11)18-3/h6-10H,4-5,16H2,1-3H3
InChIKeyFCXSHJMVQSYOSS-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

4-(3-methoxyphenyl)-3-(2-methylbutan-2-yl)-1,2-oxazol-5-amine
CID 62678255
3-(3-methoxyphenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829950
3-(3-bromophenyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61261442
3-(3-iodophenyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61263311
4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine
CID 66200696
3-(2-cyclopentylethyl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61263124
3-(5-bromofuran-2-yl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 61261819
4-(3-methoxyphenyl)-3-(1-methylpyrazol-3-yl)-1,2-oxazol-5-amine
CID 103119565
3-(3-chlorothiophen-2-yl)-4-(3-methoxyphenyl)-1,2-oxazol-5-amine
CID 80644237
4-(2-chloro-6-fluorophenyl)-3-pentan-3-yl-1,2-oxazol-5-amine
CID 43335678
3-(3-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 55079639
5-(1,1-difluoroethyl)-4-(3-methoxyphenyl)-1,2-oxazol-3-amine
CID 114249586

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine?
The IUPAC name of 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine (CID 61262192) is 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine?
The canonical SMILES for 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine is CCC(CC)c1noc(N)c1-c1cccc(OC)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine?
The InChIKey is FCXSHJMVQSYOSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-10(5-2)14-13(15(16)19-17-14)11-7-6-8-12(9-11)18-3/h6-10H,4-5,16H2,1-3H3.
What are the key properties of 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine?
4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-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 4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 61262192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).