8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol

C20H20N2O3 — CID 11964282

IUPAC8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESCOc1ccc(-c2cnc(Nc3cccc4c3CC(O)CC4)o2)cc1
InChIInChI=1S/C20H20N2O3/c1-24-16-9-6-14(7-10-16)19-12-21-20(25-19)22-18-4-2-3-13-5-8-15(23)11-17(13)18/h2-4,6-7,9-10,12,15,23H,5,8,11H2,1H3,(H,21,22)
InChIKeyGAUQEWLQXSLJGH-UHFFFAOYSA-N
MW336.39 g/mol
LogP3.94
Rot. Bonds4

About 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol

8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol (PubChem CID 11964282) has the molecular formula C20H20N2O3 and a molecular weight of 336.39 g/mol. Its IUPAC name is 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol
PubChem CID11964282
Molecular FormulaC20H20N2O3
Molecular Weight336.39 g/mol
Exact Mass336.15
IUPAC Name8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol
SMILESCOc1ccc(-c2cnc(Nc3cccc4c3CC(O)CC4)o2)cc1
InChIInChI=1S/C20H20N2O3/c1-24-16-9-6-14(7-10-16)19-12-21-20(25-19)22-18-4-2-3-13-5-8-15(23)11-17(13)18/h2-4,6-7,9-10,12,15,23H,5,8,11H2,1H3,(H,21,22)
InChIKeyGAUQEWLQXSLJGH-UHFFFAOYSA-N
XLogP3.94
TPSA67.52 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol?
The IUPAC name of 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol (CID 11964282) is 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol.
What is the SMILES notation for 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol?
The canonical SMILES for 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol is COc1ccc(-c2cnc(Nc3cccc4c3CC(O)CC4)o2)cc1.
What is the InChIKey of 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol?
The InChIKey is GAUQEWLQXSLJGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3/c1-24-16-9-6-14(7-10-16)19-12-21-20(25-19)22-18-4-2-3-13-5-8-15(23)11-17(13)18/h2-4,6-7,9-10,12,15,23H,5,8,11H2,1H3,(H,21,22).
What are the key properties of 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol?
8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol has a molecular weight of 336.39 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]amino]-1,2,3,4-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 11964282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).