2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide

C16H17N3O4 — CID 56809048

IUPAC2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide
SMILESCN(CC(N)=O)C(=O)COc1ccc(Oc2ccccn2)cc1
InChIInChI=1S/C16H17N3O4/c1-19(10-14(17)20)16(21)11-22-12-5-7-13(8-6-12)23-15-4-2-3-9-18-15/h2-9H,10-11H2,1H3,(H2,17,20)
InChIKeyLKZPCYFAOQHXGK-UHFFFAOYSA-N
MW315.33 g/mol
LogP1.20
Rot. Bonds7

About 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide

2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide (PubChem CID 56809048) has the molecular formula C16H17N3O4 and a molecular weight of 315.33 g/mol. Its IUPAC name is 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide.

Molecular Properties

Compound Name2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide
PubChem CID56809048
Molecular FormulaC16H17N3O4
Molecular Weight315.33 g/mol
Exact Mass315.12
IUPAC Name2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide
SMILESCN(CC(N)=O)C(=O)COc1ccc(Oc2ccccn2)cc1
InChIInChI=1S/C16H17N3O4/c1-19(10-14(17)20)16(21)11-22-12-5-7-13(8-6-12)23-15-4-2-3-9-18-15/h2-9H,10-11H2,1H3,(H2,17,20)
InChIKeyLKZPCYFAOQHXGK-UHFFFAOYSA-N
XLogP1.20
TPSA94.75 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(4-pyridin-2-yloxyphenoxy)acetamide;dihydrochloride
CID 119652511
N-methyl-N-[(2-methylphenyl)methyl]-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 36621925
2-[[2-(4-benzoylphenoxy)acetyl]-methylamino]acetamide
CID 56809046
N-[(3-fluorophenyl)methyl]-N-methyl-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 86920381
2-[[2-[4-(aminomethyl)phenoxy]acetyl]-methylamino]acetamide
CID 43373935
(4-methylphenyl) 2-(4-pyridin-2-yloxyphenoxy)acetate
CID 30805310
2-(4-pyridin-2-yloxyphenoxy)-N,N-bis(thiophen-2-ylmethyl)acetamide
CID 31841903
N-(2-methylpropyl)-2-(4-pyridin-2-yloxyphenoxy)-N-(2,2,2-trifluoroethyl)acetamide
CID 78877751
N-propyl-2-(4-pyridin-2-yloxyphenoxy)acetamide
CID 36805335
(4-chlorophenyl) 2-(4-pyridin-2-yloxyphenoxy)acetate
CID 30805309
N-[3-(aminomethyl)pentan-3-yl]-2-(4-pyridin-2-yloxyphenoxy)acetamide;dihydrochloride
CID 119568739
(2,3,6-trimethylphenyl) 2-(4-pyridin-2-yloxyphenoxy)acetate
CID 30765960

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide?
The IUPAC name of 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide (CID 56809048) is 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide.
What is the SMILES notation for 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide?
The canonical SMILES for 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide is CN(CC(N)=O)C(=O)COc1ccc(Oc2ccccn2)cc1.
What is the InChIKey of 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide?
The InChIKey is LKZPCYFAOQHXGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O4/c1-19(10-14(17)20)16(21)11-22-12-5-7-13(8-6-12)23-15-4-2-3-9-18-15/h2-9H,10-11H2,1H3,(H2,17,20).
What are the key properties of 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide?
2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide has a molecular weight of 315.33 g/mol, XLogP of 1.20, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[2-(4-pyridin-2-yloxyphenoxy)acetyl]amino]acetamide is sourced from PubChem (CID 56809048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).