N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide

C17H21N3O4 — CID 171909386

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide
SMILESCc1cc(NC(=O)COc2cccc(CN3CCOCC3)c2)no1
InChIInChI=1S/C17H21N3O4/c1-13-9-16(19-24-13)18-17(21)12-23-15-4-2-3-14(10-15)11-20-5-7-22-8-6-20/h2-4,9-10H,5-8,11-12H2,1H3,(H,18,19,21)
InChIKeyQJEDUBSYYQBRHS-UHFFFAOYSA-N
MW331.37 g/mol
LogP1.83
Rot. Bonds6

About N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide (PubChem CID 171909386) has the molecular formula C17H21N3O4 and a molecular weight of 331.37 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide
PubChem CID171909386
Molecular FormulaC17H21N3O4
Molecular Weight331.37 g/mol
Exact Mass331.15
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide
SMILESCc1cc(NC(=O)COc2cccc(CN3CCOCC3)c2)no1
InChIInChI=1S/C17H21N3O4/c1-13-9-16(19-24-13)18-17(21)12-23-15-4-2-3-14(10-15)11-20-5-7-22-8-6-20/h2-4,9-10H,5-8,11-12H2,1H3,(H,18,19,21)
InChIKeyQJEDUBSYYQBRHS-UHFFFAOYSA-N
XLogP1.83
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.37
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-(aminomethyl)phenoxy]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 106485131
2-(3-chlorophenoxy)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 2632943
2-(3-bromophenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 78803811
N-[4-(morpholin-4-ylmethyl)phenyl]-2-(3-propan-2-ylphenoxy)acetamide
CID 108730961
2-(4-iodophenoxy)-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 55969614
1-(5-methyl-1,2-oxazol-3-yl)-3-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]urea
CID 38886891
N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]-2-(4-phenylmethoxyphenoxy)acetamide
CID 55970132
2-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 30664497
2-(4-methylphenoxy)-N-[6-(morpholin-4-ylmethyl)-1,3-benzothiazol-2-yl]acetamide
CID 108740895
2-[3-(morpholin-4-ylmethyl)phenoxy]acetaldehyde
CID 54183396
N-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylphenyl]-2-phenoxyacetamide
CID 19630696
2-(3-methylphenoxy)-N-(6-morpholin-4-ylpyrimidin-4-yl)acetamide
CID 90544202

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide (CID 171909386) is N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide is Cc1cc(NC(=O)COc2cccc(CN3CCOCC3)c2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide?
The InChIKey is QJEDUBSYYQBRHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O4/c1-13-9-16(19-24-13)18-17(21)12-23-15-4-2-3-14(10-15)11-20-5-7-22-8-6-20/h2-4,9-10H,5-8,11-12H2,1H3,(H,18,19,21).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide has a molecular weight of 331.37 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(morpholin-4-ylmethyl)phenoxy]acetamide is sourced from PubChem (CID 171909386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).