2-(1,4-diphenylpyrazol-3-yl)acetamide

C17H15N3O — CID 21418445

IUPAC2-(1,4-diphenylpyrazol-3-yl)acetamide
SMILESNC(=O)Cc1nn(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C17H15N3O/c18-17(21)11-16-15(13-7-3-1-4-8-13)12-20(19-16)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,18,21)
InChIKeyPKQVABNQYHJNBF-UHFFFAOYSA-N
MW277.33 g/mol
LogP2.57
Rot. Bonds4

About 2-(1,4-diphenylpyrazol-3-yl)acetamide

2-(1,4-diphenylpyrazol-3-yl)acetamide (PubChem CID 21418445) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-(1,4-diphenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(1,4-diphenylpyrazol-3-yl)acetamide
PubChem CID21418445
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name2-(1,4-diphenylpyrazol-3-yl)acetamide
SMILESNC(=O)Cc1nn(-c2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C17H15N3O/c18-17(21)11-16-15(13-7-3-1-4-8-13)12-20(19-16)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,18,21)
InChIKeyPKQVABNQYHJNBF-UHFFFAOYSA-N
XLogP2.57
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2-fluorophenyl)-4-phenylpyrazol-3-yl]acetic acid
CID 12887030
1,3,4-triphenylpyrazole
CID 555882
methyl 2-(1,4-diphenylpyrazol-3-yl)oxyacetate
CID 154148416
3-[(1,4-diphenylpyrazol-3-yl)methyl]-1-phenyl-4,5,6,7-tetrahydroindazole
CID 59661100
ethyl 1-(4-aminophenyl)-4-phenylpyrazole-3-carboxylate
CID 89330372
2-chloro-N-[4-(4-chlorophenyl)-1-phenylpyrazol-3-yl]acetamide
CID 70305179
ethyl 4-(4-aminophenyl)-1-phenylpyrazole-3-carboxylate
CID 12886956
2-(1,4-diphenylpyrazol-3-yl)benzenesulfonamide
CID 173207476
2-[(1-phenyl-1,2,4-triazol-3-yl)oxy]acetamide
CID 1486531
sodium 2-[4-(4-chlorophenyl)-1-(4-fluorophenyl)pyrazol-3-yl]acetate
CID 23674741
2-(1,3-diphenylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxylic acid
CID 118727567
1,1'-biphenyl;2-hydroxyacetamide
CID 174302760

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-diphenylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(1,4-diphenylpyrazol-3-yl)acetamide (CID 21418445) is 2-(1,4-diphenylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(1,4-diphenylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(1,4-diphenylpyrazol-3-yl)acetamide is NC(=O)Cc1nn(-c2ccccc2)cc1-c1ccccc1.
What is the InChIKey of 2-(1,4-diphenylpyrazol-3-yl)acetamide?
The InChIKey is PKQVABNQYHJNBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c18-17(21)11-16-15(13-7-3-1-4-8-13)12-20(19-16)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,18,21).
What are the key properties of 2-(1,4-diphenylpyrazol-3-yl)acetamide?
2-(1,4-diphenylpyrazol-3-yl)acetamide has a molecular weight of 277.33 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-diphenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 21418445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).