2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide

C18H15F2N3O — CID 97051340

IUPAC2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide
SMILESCc1ccccc1-n1nccc1NC(=O)Cc1ccc(F)cc1F
InChIInChI=1S/C18H15F2N3O/c1-12-4-2-3-5-16(12)23-17(8-9-21-23)22-18(24)10-13-6-7-14(19)11-15(13)20/h2-9,11H,10H2,1H3,(H,22,24)
InChIKeyAAOYXIZXGVTIAX-UHFFFAOYSA-N
MW327.33 g/mol
LogP3.64
Rot. Bonds4

About 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide

2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide (PubChem CID 97051340) has the molecular formula C18H15F2N3O and a molecular weight of 327.33 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide
PubChem CID97051340
Molecular FormulaC18H15F2N3O
Molecular Weight327.33 g/mol
Exact Mass327.12
IUPAC Name2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide
SMILESCc1ccccc1-n1nccc1NC(=O)Cc1ccc(F)cc1F
InChIInChI=1S/C18H15F2N3O/c1-12-4-2-3-5-16(12)23-17(8-9-21-23)22-18(24)10-13-6-7-14(19)11-15(13)20/h2-9,11H,10H2,1H3,(H,22,24)
InChIKeyAAOYXIZXGVTIAX-UHFFFAOYSA-N
XLogP3.64
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.33
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-difluorophenyl)-N-(2,6-dimethylphenyl)acetamide
CID 110488922
2-ethoxy-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
CID 56789802
3-(5-chloro-3-methyl-1,2-oxazol-4-yl)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
CID 126787813
(2R)-N-[2-(2-methylphenyl)pyrazol-3-yl]-2-methylsulfanylpropanamide
CID 96539727
2-(2,4-difluorophenyl)-N-(2-pyrazol-1-ylpyrimidin-5-yl)acetamide
CID 122300328
2-(2,4-difluorophenyl)-N-(4-methyl-1H-pyrazol-5-yl)acetamide
CID 113253808
1-(3-hydroxybutyl)-3-[2-(2-methylphenyl)pyrazol-3-yl]urea
CID 84598091
2,4,5-trimethoxy-N-[2-(2-methylphenyl)pyrazol-3-yl]benzamide
CID 75467532
2-(2,4-difluorophenyl)-N-[2-(2-fluorophenoxy)-4,6-dimethylpyrimidin-5-yl]acetamide
CID 122303430
2-(2,4-difluorophenyl)-N-pyridin-3-ylacetamide
CID 110488862
N-[2-[[2-(2-methylphenyl)pyrazol-3-yl]carbamoylamino]ethyl]cyclopropanecarboxamide
CID 84598089
2-(2-chloro-4-fluorophenyl)-N-[(1S)-1-[5-methyl-1-(2-methylphenyl)pyrazol-4-yl]ethyl]acetamide
CID 42525671

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide?
The IUPAC name of 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide (CID 97051340) is 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide?
The canonical SMILES for 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide is Cc1ccccc1-n1nccc1NC(=O)Cc1ccc(F)cc1F.
What is the InChIKey of 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide?
The InChIKey is AAOYXIZXGVTIAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15F2N3O/c1-12-4-2-3-5-16(12)23-17(8-9-21-23)22-18(24)10-13-6-7-14(19)11-15(13)20/h2-9,11H,10H2,1H3,(H,22,24).
What are the key properties of 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide?
2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide has a molecular weight of 327.33 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-N-[2-(2-methylphenyl)pyrazol-3-yl]acetamide is sourced from PubChem (CID 97051340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).