5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide

C20H26N2O5 — CID 24792927

IUPAC5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccccc1OCc1cc(C(=O)N(C)CCC2CCCCO2)no1
InChIInChI=1S/C20H26N2O5/c1-22(11-10-15-7-5-6-12-25-15)20(23)17-13-16(27-21-17)14-26-19-9-4-3-8-18(19)24-2/h3-4,8-9,13,15H,5-7,10-12,14H2,1-2H3
InChIKeyGEGALIGBNXCNKA-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.29
Rot. Bonds8

About 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide

5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide (PubChem CID 24792927) has the molecular formula C20H26N2O5 and a molecular weight of 374.44 g/mol. Its IUPAC name is 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide
PubChem CID24792927
Molecular FormulaC20H26N2O5
Molecular Weight374.44 g/mol
Exact Mass374.18
IUPAC Name5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide
SMILESCOc1ccccc1OCc1cc(C(=O)N(C)CCC2CCCCO2)no1
InChIInChI=1S/C20H26N2O5/c1-22(11-10-15-7-5-6-12-25-15)20(23)17-13-16(27-21-17)14-26-19-9-4-3-8-18(19)24-2/h3-4,8-9,13,15H,5-7,10-12,14H2,1-2H3
InChIKeyGEGALIGBNXCNKA-UHFFFAOYSA-N
XLogP3.29
TPSA74.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide (CID 24792927) is 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide is COc1ccccc1OCc1cc(C(=O)N(C)CCC2CCCCO2)no1.
What is the InChIKey of 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
The InChIKey is GEGALIGBNXCNKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O5/c1-22(11-10-15-7-5-6-12-25-15)20(23)17-13-16(27-21-17)14-26-19-9-4-3-8-18(19)24-2/h3-4,8-9,13,15H,5-7,10-12,14H2,1-2H3.
What are the key properties of 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide?
5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 3.29, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenoxy)methyl]-N-methyl-N-[2-(oxan-2-yl)ethyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 24792927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).