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

C16H15N3O2 — CID 106754464

IUPAC4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine
SMILESCOc1ccc(-c2c(N)noc2-c2ccnc(C)c2)cc1
InChIInChI=1S/C16H15N3O2/c1-10-9-12(7-8-18-10)15-14(16(17)19-21-15)11-3-5-13(20-2)6-4-11/h3-9H,1-2H3,(H2,17,19)
InChIKeyVXDVGAQNXMFUPV-UHFFFAOYSA-N
MW281.32 g/mol
LogP3.30
Rot. Bonds3

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

4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine (PubChem CID 106754464) has the molecular formula C16H15N3O2 and a molecular weight of 281.32 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine
PubChem CID106754464
Molecular FormulaC16H15N3O2
Molecular Weight281.32 g/mol
Exact Mass281.12
IUPAC Name4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine
SMILESCOc1ccc(-c2c(N)noc2-c2ccnc(C)c2)cc1
InChIInChI=1S/C16H15N3O2/c1-10-9-12(7-8-18-10)15-14(16(17)19-21-15)11-3-5-13(20-2)6-4-11/h3-9H,1-2H3,(H2,17,19)
InChIKeyVXDVGAQNXMFUPV-UHFFFAOYSA-N
XLogP3.30
TPSA74.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(3-methoxy-4-methylphenyl)-4-pyridin-4-yl-1,2-oxazol-3-amine
CID 80525603
4-(3-chlorophenyl)-5-(4-methoxyphenyl)-1,2-oxazol-3-amine
CID 66198897
5-(2-chlorophenyl)-4-(4-methoxyphenyl)-1,2-oxazol-3-amine
CID 66198750
4-(2-fluorophenyl)-5-(4-methoxyphenyl)-1,2-oxazol-3-amine
CID 66200762
4-(2-chlorophenyl)-5-(4-methoxyphenyl)-1,2-oxazol-3-amine
CID 66204576
3-amino-5-(4-methoxyphenyl)-1,2-oxazole-4-carbonitrile
CID 83704376
6-methoxy-9-(2-methyl-4-pyridinyl)-1H-diazonine
CID 123778324
2-[3-amino-4-(4-methoxyphenyl)-1,2-oxazol-5-yl]-4-ethyl-5-methoxyphenol
CID 952905
5-(2-methoxy-3-pyridinyl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66199868
4-(4-methoxyphenyl)-5-(3-methylbutan-2-yl)-1,2-oxazol-3-amine
CID 66198552
5-(4-methylphenyl)-4-phenyl-1,2-oxazol-3-amine
CID 66199506
4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
CID 66199843

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine (CID 106754464) is 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine is COc1ccc(-c2c(N)noc2-c2ccnc(C)c2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine?
The InChIKey is VXDVGAQNXMFUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2/c1-10-9-12(7-8-18-10)15-14(16(17)19-21-15)11-3-5-13(20-2)6-4-11/h3-9H,1-2H3,(H2,17,19).
What are the key properties of 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine?
4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine has a molecular weight of 281.32 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-5-(2-methyl-4-pyridinyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 106754464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).