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

C15H20N2O2 — CID 66200696

IUPAC4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine
SMILESCCCC(C)c1onc(N)c1-c1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-6-10(2)14-13(15(16)17-19-14)11-7-5-8-12(9-11)18-3/h5,7-10H,4,6H2,1-3H3,(H2,16,17)
InChIKeyFCNMWYYEVQQREM-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.84
Rot. Bonds5

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

4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine (PubChem CID 66200696) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine
PubChem CID66200696
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine
SMILESCCCC(C)c1onc(N)c1-c1cccc(OC)c1
InChIInChI=1S/C15H20N2O2/c1-4-6-10(2)14-13(15(16)17-19-14)11-7-5-8-12(9-11)18-3/h5,7-10H,4,6H2,1-3H3,(H2,16,17)
InChIKeyFCNMWYYEVQQREM-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-bromophenyl)-5-heptan-4-yl-1,2-oxazol-3-amine
CID 82987497
5-butan-2-yl-4-phenyl-1,2-oxazol-3-amine
CID 66200306
5-(1,1-difluoroethyl)-4-(3-methoxyphenyl)-1,2-oxazol-3-amine
CID 114249586
4-(3-methoxyphenyl)-3-pentan-3-yl-1,2-oxazol-5-amine
CID 61262192
5-heptan-4-yl-4-pyridin-3-yl-1,2-oxazol-3-amine
CID 82988157
4-(3-methoxyphenyl)-5-(oxan-3-yl)-1,2-oxazol-3-amine
CID 66200693
4-(3-methoxyphenyl)-3-(2-methylbutan-2-yl)-1,2-oxazol-5-amine
CID 62678255
4-(4-methoxyphenyl)-5-(3-methylbutan-2-yl)-1,2-oxazol-3-amine
CID 66198552
4-(3-chlorophenyl)-5-heptan-3-yl-1,2-oxazol-3-amine
CID 66200299
5-(3-methylbutan-2-yl)-4-(3-methylphenyl)-1,2-oxazol-3-amine
CID 66199484
5-(2,5-dichlorothiophen-3-yl)-4-(3-methoxyphenyl)-1,2-oxazol-3-amine
CID 107967198
5-(2-bicyclo[2.2.1]heptanyl)-4-(3-methoxyphenyl)-1,2-oxazol-3-amine
CID 66200884

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine?
The IUPAC name of 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine (CID 66200696) is 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine?
The canonical SMILES for 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine is CCCC(C)c1onc(N)c1-c1cccc(OC)c1.
What is the InChIKey of 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine?
The InChIKey is FCNMWYYEVQQREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-6-10(2)14-13(15(16)17-19-14)11-7-5-8-12(9-11)18-3/h5,7-10H,4,6H2,1-3H3,(H2,16,17).
What are the key properties of 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine?
4-(3-methoxyphenyl)-5-pentan-2-yl-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 4-(3-methoxyphenyl)-5-pentan-2-yl-1,2-oxazol-3-amine is sourced from PubChem (CID 66200696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).