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

C18H18N4O2 — CID 126421596

IUPAC2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide
SMILESCc1ccncc1NC(=O)COc1nn(-c2ccccc2)cc1C
InChIInChI=1S/C18H18N4O2/c1-13-8-9-19-10-16(13)20-17(23)12-24-18-14(2)11-22(21-18)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,23)
InChIKeyXZFLUFAQXYNIHC-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.90
Rot. Bonds5

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

2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide (PubChem CID 126421596) 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-(4-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide
PubChem CID126421596
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide
SMILESCc1ccncc1NC(=O)COc1nn(-c2ccccc2)cc1C
InChIInChI=1S/C18H18N4O2/c1-13-8-9-19-10-16(13)20-17(23)12-24-18-14(2)11-22(21-18)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,23)
InChIKeyXZFLUFAQXYNIHC-UHFFFAOYSA-N
XLogP2.90
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-2-ylmethyl)acetamide
CID 100819848
N-cyclopentyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxyacetamide
CID 100819839
2-(4-chlorophenoxy)-N-(4-methyl-3-pyridinyl)acetamide
CID 56826553
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-1-piperidin-1-ylethanone
CID 100819889
1-(4-ethylpiperazin-1-yl)-2-(4-methyl-1-phenylpyrazol-3-yl)oxyethanone
CID 100828971
2-(2-aminoethoxy)-N-(4-methyl-3-pyridinyl)acetamide
CID 79478693
(2R)-2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-pyridin-2-ylpropanamide
CID 100819781
2-bromo-N-(4-methyl-3-pyridinyl)acetamide
CID 63678424
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-1-[(3S)-3-methylpiperidin-1-yl]ethanone
CID 100819878
N-(4-methyl-3-pyridinyl)-2-(propylamino)acetamide
CID 63327491
4-hydroxy-N-(4-methyl-3-pyridinyl)pentanamide
CID 79191742
(2R)-2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-prop-2-enylpropanamide
CID 100819734

Frequently Asked Questions

What is the IUPAC name of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide?
The IUPAC name of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide (CID 126421596) is 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide is Cc1ccncc1NC(=O)COc1nn(-c2ccccc2)cc1C.
What is the InChIKey of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide?
The InChIKey is XZFLUFAQXYNIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-13-8-9-19-10-16(13)20-17(23)12-24-18-14(2)11-22(21-18)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3,(H,20,23).
What are the key properties of 2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide?
2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(4-methyl-3-pyridinyl)acetamide has a molecular weight of 322.37 g/mol, XLogP of 2.90, 5 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-(4-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 126421596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).