5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one

C25H25FN6O2 — CID 155153361

IUPAC5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one
SMILESCn1cc(-c2ccn3nc(N)nc3c2)cc(C(=O)N2CCCC(Cc3ccc(F)cc3)C2)c1=O
InChIInChI=1S/C25H25FN6O2/c1-30-15-19(18-8-10-32-22(13-18)28-25(27)29-32)12-21(23(30)33)24(34)31-9-2-3-17(14-31)11-16-4-6-20(26)7-5-16/h4-8,10,12-13,15,17H,2-3,9,11,14H2,1H3,(H2,27,29)
InChIKeyMZSWFNKAWJNLFH-UHFFFAOYSA-N
MW460.51 g/mol
LogP2.91
Rot. Bonds4

About 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one

5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one (PubChem CID 155153361) has the molecular formula C25H25FN6O2 and a molecular weight of 460.51 g/mol. Its IUPAC name is 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one
PubChem CID155153361
Molecular FormulaC25H25FN6O2
Molecular Weight460.51 g/mol
Exact Mass460.20
IUPAC Name5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one
SMILESCn1cc(-c2ccn3nc(N)nc3c2)cc(C(=O)N2CCCC(Cc3ccc(F)cc3)C2)c1=O
InChIInChI=1S/C25H25FN6O2/c1-30-15-19(18-8-10-32-22(13-18)28-25(27)29-32)12-21(23(30)33)24(34)31-9-2-3-17(14-31)11-16-4-6-20(26)7-5-16/h4-8,10,12-13,15,17H,2-3,9,11,14H2,1H3,(H2,27,29)
InChIKeyMZSWFNKAWJNLFH-UHFFFAOYSA-N
XLogP2.91
TPSA98.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.51
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one with MolForge

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Related Compounds

[5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-2-methoxy-3-pyridinyl]-[3-[(4-methoxyphenyl)methyl]piperidin-1-yl]methanone
CID 150349405
3-[(3S)-3-[2-(4-fluorophenyl)ethyl]piperidine-1-carbonyl]-1,5,6-trimethylpyridin-2-one
CID 95552362
3-[3-[2-(4-fluorophenyl)ethyl]piperidine-1-carbonyl]-1,5,6-trimethylpyridin-2-one
CID 56872412
1-methyl-5-[(3S)-3-[(4-methylphenyl)methyl]piperidine-1-carbonyl]pyridin-2-one
CID 95289755
7-(4-fluorophenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82556367
[3-[2-(4-fluorophenyl)ethyl]piperidin-1-yl]-(3-methylimidazol-4-yl)methanone
CID 56868776
(1-aminocyclopropyl)-[(3S)-3-[(4-fluorophenyl)methyl]piperidin-1-yl]methanone
CID 59084329
3-[(3R)-3-aminopiperidine-1-carbonyl]-1-methylpyridin-2-one
CID 129493140
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-fluoro-2-methylbenzoic acid
CID 169003892
3-[3-[2-(4-fluorophenyl)ethyl]piperidine-1-carbonyl]-1H-pyridin-2-one
CID 56919385
4-[[1-(3-fluoropyridine-4-carbonyl)piperidin-3-yl]methyl]benzoic acid
CID 56911987
(2,4-dimethylpyrimidin-5-yl)-[3-[2-(4-fluorophenyl)ethyl]piperidin-1-yl]methanone
CID 56864739

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one?
The IUPAC name of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one (CID 155153361) is 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one.
What is the SMILES notation for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one?
The canonical SMILES for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one is Cn1cc(-c2ccn3nc(N)nc3c2)cc(C(=O)N2CCCC(Cc3ccc(F)cc3)C2)c1=O.
What is the InChIKey of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one?
The InChIKey is MZSWFNKAWJNLFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25FN6O2/c1-30-15-19(18-8-10-32-22(13-18)28-25(27)29-32)12-21(23(30)33)24(34)31-9-2-3-17(14-31)11-16-4-6-20(26)7-5-16/h4-8,10,12-13,15,17H,2-3,9,11,14H2,1H3,(H2,27,29).
What are the key properties of 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one?
5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one has a molecular weight of 460.51 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)-3-[3-[(4-fluorophenyl)methyl]piperidine-1-carbonyl]-1-methylpyridin-2-one is sourced from PubChem (CID 155153361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).