1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol

C15H20N2O4 — CID 106372231

IUPAC1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
SMILESCOc1ccccc1OCC(O)CNCc1ncc(C)o1
InChIInChI=1S/C15H20N2O4/c1-11-7-17-15(21-11)9-16-8-12(18)10-20-14-6-4-3-5-13(14)19-2/h3-7,12,16,18H,8-10H2,1-2H3
InChIKeyDWYKXXMIQFQIBP-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.52
Rot. Bonds8

About 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol

1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol (PubChem CID 106372231) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol.

Molecular Properties

Compound Name1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
PubChem CID106372231
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
SMILESCOc1ccccc1OCC(O)CNCc1ncc(C)o1
InChIInChI=1S/C15H20N2O4/c1-11-7-17-15(21-11)9-16-8-12(18)10-20-14-6-4-3-5-13(14)19-2/h3-7,12,16,18H,8-10H2,1-2H3
InChIKeyDWYKXXMIQFQIBP-UHFFFAOYSA-N
XLogP1.52
TPSA76.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-bromo-4-methylphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
CID 106371950
1-[(5-ethyl-1,3-oxazol-2-yl)methylamino]-3-(2-methylphenoxy)propan-2-ol
CID 106370990
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol
CID 106371905
1-(2-methoxyphenoxy)-3-(1,2-oxazol-3-ylmethylamino)propan-2-ol
CID 81177818
1-[(5-methyl-1,3-oxazol-2-yl)methylamino]-3-octoxypropan-2-ol
CID 106371765
1-(2-methoxyphenoxy)-3-(2-methylprop-2-enylamino)propan-2-ol
CID 114616905
methyl 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]-2-phenylpropanoate
CID 106372343
1-(2-methoxyphenoxy)-3-(2-methylsulfanylethylamino)propan-2-ol
CID 63965784
4-[[2-hydroxy-3-(2-methoxyphenoxy)propyl]amino]-1-methoxybutan-2-ol
CID 106246755
1-(2-chlorophenyl)-1-(2-methoxyphenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 122145179
2-[[2-hydroxy-3-(2-methoxyphenoxy)propyl]amino]-N-methylacetamide
CID 60901229
1-[(2-cyclopropyl-2-hydroxyethyl)amino]-3-(2-methoxyphenoxy)propan-2-ol
CID 63296623

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol?
The IUPAC name of 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol (CID 106372231) is 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol.
What is the SMILES notation for 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol?
The canonical SMILES for 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol is COc1ccccc1OCC(O)CNCc1ncc(C)o1.
What is the InChIKey of 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol?
The InChIKey is DWYKXXMIQFQIBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-11-7-17-15(21-11)9-16-8-12(18)10-20-14-6-4-3-5-13(14)19-2/h3-7,12,16,18H,8-10H2,1-2H3.
What are the key properties of 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol?
1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol has a molecular weight of 292.34 g/mol, XLogP of 1.52, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol is sourced from PubChem (CID 106372231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).