[4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone

C27H21FN4O — CID 21027392

IUPAC[4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone
SMILESCN(C)c1ccc(C(=O)c2cccc3c(-c4ccncc4)c(-c4ccc(F)cc4)nn23)cc1
InChIInChI=1S/C27H21FN4O/c1-31(2)22-12-8-20(9-13-22)27(33)24-5-3-4-23-25(18-14-16-29-17-15-18)26(30-32(23)24)19-6-10-21(28)11-7-19/h3-17H,1-2H3
InChIKeyVSJCFRZXSMCKAR-UHFFFAOYSA-N
MW436.49 g/mol
LogP5.50
Rot. Bonds5

About [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone

[4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone (PubChem CID 21027392) has the molecular formula C27H21FN4O and a molecular weight of 436.49 g/mol. Its IUPAC name is [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone.

Molecular Properties

Compound Name[4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone
PubChem CID21027392
Molecular FormulaC27H21FN4O
Molecular Weight436.49 g/mol
Exact Mass436.17
IUPAC Name[4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone
SMILESCN(C)c1ccc(C(=O)c2cccc3c(-c4ccncc4)c(-c4ccc(F)cc4)nn23)cc1
InChIInChI=1S/C27H21FN4O/c1-31(2)22-12-8-20(9-13-22)27(33)24-5-3-4-23-25(18-14-16-29-17-15-18)26(30-32(23)24)19-6-10-21(28)11-7-19/h3-17H,1-2H3
InChIKeyVSJCFRZXSMCKAR-UHFFFAOYSA-N
XLogP5.50
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500436.49
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone with MolForge

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Related Compounds

N-(3-fluoro-4-pyridinyl)-2-phenylpyrazolo[1,5-a]pyridine-6-carboxamide
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CID 54759170
[4-[2-(2,4-Difluorophenyl)ethyl]piperazin-1-yl]-pyrazolo[1,5-a]pyridin-7-ylmethanone
CID 57400053
(3-Fluorophenyl)-(2-methylindolizin-3-yl)methanone
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(2-Fluorophenyl)-(2-methylindolizin-3-yl)methanone
CID 2322045
N-{[3-(4-fluorobenzoyl)-2-methylindolizin-1-yl]methylidene}hydroxylamine
CID 6904896
2-phenyl-3-pyridin-4-yl-6,7-dihydro-5H-indazol-4-one
CID 3241417
N-Pyridin-4-yl-4-(3-pyridin-3-yl-5-trifluoromethyl-pyrazol-1-yl)-benzamide
CID 17748340
3-Cyano-1-(4-pyrazol-1-yl-benzoyl)-pyrrolo[1,2-a]quinoline
CID 21892147
(4-Fluoro-4-(((5-methylpyridin-2-yl)methylamino)methyl)piperidin-1-yl)(pyrazolo[1,5-a]pyridin-2-yl)methanone
CID 42606577
3-((4-(6-Methylpyridin-2-yl)-3-(quinolin-6-yl)-1H-pyrazol-1-yl)methyl)benzamide
CID 46907179
1-[1-[4-[4-(4-Fluorophenyl)piperazin-1-yl]butyl]indol-5-yl]ethanone
CID 56642299

Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone?
The IUPAC name of [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone (CID 21027392) is [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone.
What is the SMILES notation for [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone?
The canonical SMILES for [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone is CN(C)c1ccc(C(=O)c2cccc3c(-c4ccncc4)c(-c4ccc(F)cc4)nn23)cc1.
What is the InChIKey of [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone?
The InChIKey is VSJCFRZXSMCKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21FN4O/c1-31(2)22-12-8-20(9-13-22)27(33)24-5-3-4-23-25(18-14-16-29-17-15-18)26(30-32(23)24)19-6-10-21(28)11-7-19/h3-17H,1-2H3.
What are the key properties of [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone?
[4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone has a molecular weight of 436.49 g/mol, XLogP of 5.50, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)phenyl]-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-7-yl]methanone is sourced from PubChem (CID 21027392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).