2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide

C13H15N3O3 — CID 112691162

IUPAC2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCOc1ccc(OCC(=O)Nc2[nH]ncc2C)cc1
InChIInChI=1S/C13H15N3O3/c1-9-7-14-16-13(9)15-12(17)8-19-11-5-3-10(18-2)4-6-11/h3-7H,8H2,1-2H3,(H2,14,15,16,17)
InChIKeyMBJSJRWUFATXQQ-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.74
Rot. Bonds5

About 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide

2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide (PubChem CID 112691162) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
PubChem CID112691162
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC Name2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
SMILESCOc1ccc(OCC(=O)Nc2[nH]ncc2C)cc1
InChIInChI=1S/C13H15N3O3/c1-9-7-14-16-13(9)15-12(17)8-19-11-5-3-10(18-2)4-6-11/h3-7H,8H2,1-2H3,(H2,14,15,16,17)
InChIKeyMBJSJRWUFATXQQ-UHFFFAOYSA-N
XLogP1.74
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)propanamide
CID 115630345
2-(2,3-dihydro-1H-inden-5-yloxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115630112
2-(3-bromophenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 112691197
2-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 115629929
2-(4-ethylphenoxy)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
CID 115680804
2-(4-methoxyphenoxy)-N-(6-methyl-2-pyridinyl)acetamide
CID 3146339
N-(2,4-dimethylphenyl)-2-(4-methoxyphenoxy)acetamide
CID 625191
methyl 3-[[2-(4-methoxyphenoxy)acetyl]amino]-4-methylbenzoate
CID 806985
2-hydroxy-5-methoxy-N-(4-methyl-1H-pyrazol-5-yl)benzamide
CID 112691144
2-(4-methoxyphenoxy)-N-methylacetamide
CID 606867
N-(2,4-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 868059
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide (CID 112691162) is 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide is COc1ccc(OCC(=O)Nc2[nH]ncc2C)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
The InChIKey is MBJSJRWUFATXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-9-7-14-16-13(9)15-12(17)8-19-11-5-3-10(18-2)4-6-11/h3-7H,8H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide?
2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide has a molecular weight of 261.28 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-(4-methyl-1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 112691162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).