N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide

C22H17FN4O — CID 15513074

IUPACN-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C22H17FN4O/c23-18-8-6-17(7-9-18)21-20(16-10-12-24-13-11-16)22(27-26-21)25-19(28)14-15-4-2-1-3-5-15/h1-13H,14H2,(H2,25,26,27,28)
InChIKeyBDSZOAWKWSYMDS-UHFFFAOYSA-N
MW372.40 g/mol
LogP4.46
Rot. Bonds5

About N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide

N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide (PubChem CID 15513074) has the molecular formula C22H17FN4O and a molecular weight of 372.40 g/mol. Its IUPAC name is N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide
PubChem CID15513074
Molecular FormulaC22H17FN4O
Molecular Weight372.40 g/mol
Exact Mass372.14
IUPAC NameN-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1
InChIInChI=1S/C22H17FN4O/c23-18-8-6-17(7-9-18)21-20(16-10-12-24-13-11-16)22(27-26-21)25-19(28)14-15-4-2-1-3-5-15/h1-13H,14H2,(H2,25,26,27,28)
InChIKeyBDSZOAWKWSYMDS-UHFFFAOYSA-N
XLogP4.46
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.40
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Apinocaltamide
CID 118560618
(3S)-3-({5-Chloro-4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]pyrimidin-2-yl}amino)-3-(4-fluorophenyl)-N-methylpropanamide
CID 11441796
N-[5-(pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridazin-3-yl]cyclopropanecarboxamide
CID 6539561
N-(5-Phenyl-1H-pyrazolo[3,4-c]pyridin-3-yl)butanamide
CID 6539526
N-(6-(pyridin-4-yl)-1H-indazol-3-yl)butyramide
CID 10085059
(4-((6-(1H-pyrazol-3-ylamino)pyridin-2-yl)methyl)piperazin-1-yl)(2-fluoro-3-(trifluoromethyl)phenyl)methanone
CID 11705035
N-[1-[(3,4-difluorophenyl)methyl]pyrazol-3-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 118560409
1-[3-Tert-Butyl-1-(4-Methylphenyl)-1h-Pyrazol-5-Yl]-3-[4-(Pyridin-3-Yl)phenyl]urea
CID 71695585
2-[4-[[4-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-6-[(3-methyl-1~{H}-pyrazol-5-yl)amino]pyrimidin-2-yl]amino]phenyl]-~{N}-(3-fluorophenyl)ethanamide
CID 162540425
N-(6-(pyridin-3-yl)-1H-indazol-3-yl)butyramide
CID 10016510
2,3-Dihydro-1H-cyclopenta[a]naphthalene-2-carboxylic acid [5-(2-ethyl-pyridin-4-yl)-1H-pyrazol-3-yl]-amide
CID 9907999
2,3-Dihydro-1H-cyclopenta[a]naphthalene-2-carboxylic acid (5-pyridin-4-yl-1H-pyrazol-3-yl)-amide
CID 10970274

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide?
The IUPAC name of N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide (CID 15513074) is N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide.
What is the SMILES notation for N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide?
The canonical SMILES for N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide is O=C(Cc1ccccc1)Nc1n[nH]c(-c2ccc(F)cc2)c1-c1ccncc1.
What is the InChIKey of N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide?
The InChIKey is BDSZOAWKWSYMDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17FN4O/c23-18-8-6-17(7-9-18)21-20(16-10-12-24-13-11-16)22(27-26-21)25-19(28)14-15-4-2-1-3-5-15/h1-13H,14H2,(H2,25,26,27,28).
What are the key properties of N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide?
N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide has a molecular weight of 372.40 g/mol, XLogP of 4.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]-2-phenylacetamide is sourced from PubChem (CID 15513074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).