2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide

C19H17F2N3O — CID 162677721

IUPAC2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide
SMILESCCc1cc(NC(=O)Cc2ccc(F)c(F)c2)n(-c2ccccc2)n1
InChIInChI=1S/C19H17F2N3O/c1-2-14-12-18(24(23-14)15-6-4-3-5-7-15)22-19(25)11-13-8-9-16(20)17(21)10-13/h3-10,12H,2,11H2,1H3,(H,22,25)
InChIKeyVUCKLSQPTMRCOY-UHFFFAOYSA-N
MW341.36 g/mol
LogP3.89
Rot. Bonds5

About 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide

2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide (PubChem CID 162677721) has the molecular formula C19H17F2N3O and a molecular weight of 341.36 g/mol. Its IUPAC name is 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide
PubChem CID162677721
Molecular FormulaC19H17F2N3O
Molecular Weight341.36 g/mol
Exact Mass341.13
IUPAC Name2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide
SMILESCCc1cc(NC(=O)Cc2ccc(F)c(F)c2)n(-c2ccccc2)n1
InChIInChI=1S/C19H17F2N3O/c1-2-14-12-18(24(23-14)15-6-4-3-5-7-15)22-19(25)11-13-8-9-16(20)17(21)10-13/h3-10,12H,2,11H2,1H3,(H,22,25)
InChIKeyVUCKLSQPTMRCOY-UHFFFAOYSA-N
XLogP3.89
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.36
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-tert-butyl-1-phenylpyrazol-5-yl)-2-[(3,4-difluorophenyl)carbamoyl-ethylamino]acetamide
CID 1052585
1-(3,4-difluorophenyl)-3-(5-methyl-2-phenylpyrazol-3-yl)urea
CID 56642816
2-(3,4-difluorophenyl)-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 112698162
N-[1-(4-bromophenyl)-3-tert-butylpyrazol-5-yl]-2-phenylacetamide
CID 46087859
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(4-ethylphenyl)acetamide
CID 99632483
tert-butyl N-[3-(2-hydrazinyl-2-oxoethyl)-1-phenylpyrazol-5-yl]carbamate
CID 118408921
N-[(3,4-difluorophenyl)methyl]-2-phenylacetamide
CID 110781029
N-benzyl-N-[2-[(3-tert-butyl-1-phenylpyrazol-5-yl)amino]-2-oxoethyl]-2-(4-fluorophenyl)acetamide
CID 42740947
2-(3-fluoro-4-methoxyphenyl)-N-(1-phenylpyrazol-3-yl)acetamide
CID 135315910
1-(3,4-difluorophenyl)-3-(1,3-diphenylpyrazol-5-yl)urea
CID 71812409
diethyl-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]azanium
CID 6932117
2-(4-aminophenyl)-N-(3-cyclopentyl-1-phenylpyrazol-5-yl)acetamide
CID 119684822

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide?
The IUPAC name of 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide (CID 162677721) is 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide?
The canonical SMILES for 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide is CCc1cc(NC(=O)Cc2ccc(F)c(F)c2)n(-c2ccccc2)n1.
What is the InChIKey of 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide?
The InChIKey is VUCKLSQPTMRCOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2N3O/c1-2-14-12-18(24(23-14)15-6-4-3-5-7-15)22-19(25)11-13-8-9-16(20)17(21)10-13/h3-10,12H,2,11H2,1H3,(H,22,25).
What are the key properties of 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide?
2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide has a molecular weight of 341.36 g/mol, XLogP of 3.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-difluorophenyl)-N-(3-ethyl-1-phenylpyrazol-5-yl)acetamide is sourced from PubChem (CID 162677721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).