2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide

C18H18N4O2 — CID 100819848

IUPAC2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
SMILESCc1cn(-c2ccccc2)nc1OCC(=O)NCc1ccccn1
InChIInChI=1S/C18H18N4O2/c1-14-12-22(16-8-3-2-4-9-16)21-18(14)24-13-17(23)20-11-15-7-5-6-10-19-15/h2-10,12H,11,13H2,1H3,(H,20,23)
InChIKeyRWGZWHDTGHOKBW-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.27
Rot. Bonds6

About 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide

2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide (PubChem CID 100819848) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
PubChem CID100819848
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
SMILESCc1cn(-c2ccccc2)nc1OCC(=O)NCc1ccccn1
InChIInChI=1S/C18H18N4O2/c1-14-12-22(16-8-3-2-4-9-16)21-18(14)24-13-17(23)20-11-15-7-5-6-10-19-15/h2-10,12H,11,13H2,1H3,(H,20,23)
InChIKeyRWGZWHDTGHOKBW-UHFFFAOYSA-N
XLogP2.27
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide
CID 126421596
2-phenoxy-N-(pyridin-2-ylmethyl)acetamide
CID 853197
2-(4-chloro-2,6-dimethylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 9414673
(2R)-2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-pyridin-2-ylpropanamide
CID 100819781
N-(pyridin-2-ylmethyl)-2-(2,4,6-tribromophenoxy)acetamide
CID 17359500
2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(pyridin-2-ylmethyl)acetamide
CID 9206139
2-(4-propoxyphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 35750358
2-(3-acetylphenoxy)-N-(pyridin-2-ylmethyl)acetamide
CID 40628702
1-(4-ethylpiperazin-1-yl)-2-(4-methyl-1-phenylpyrazol-3-yl)oxyethanone
CID 100828971
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(2-methylpropyl)propanamide
CID 102552852
(2S)-2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(2-methylpropyl)propanamide
CID 100819736
2-(2,6-dimethylphenoxy)-N-(2-pyridin-2-ylethyl)acetamide
CID 29292137

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide (CID 100819848) is 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide is Cc1cn(-c2ccccc2)nc1OCC(=O)NCc1ccccn1.
What is the InChIKey of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
The InChIKey is RWGZWHDTGHOKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-14-12-22(16-8-3-2-4-9-16)21-18(14)24-13-17(23)20-11-15-7-5-6-10-19-15/h2-10,12H,11,13H2,1H3,(H,20,23).
What are the key properties of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide?
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide has a molecular weight of 322.37 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide is sourced from PubChem (CID 100819848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).