methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate

C21H17FN4O2 — CID 178078879

IUPACmethyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate
SMILESCOC(=O)NCc1ccc2c(-c3ccncc3)c(-c3ccc(F)cc3)nn2c1
InChIInChI=1S/C21H17FN4O2/c1-28-21(27)24-12-14-2-7-18-19(15-8-10-23-11-9-15)20(25-26(18)13-14)16-3-5-17(22)6-4-16/h2-11,13H,12H2,1H3,(H,24,27)
InChIKeyAXZZWMDLQYZJRE-UHFFFAOYSA-N
MW376.39 g/mol
LogP4.06
Rot. Bonds4

About methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate

methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate (PubChem CID 178078879) has the molecular formula C21H17FN4O2 and a molecular weight of 376.39 g/mol. Its IUPAC name is methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate.

Molecular Properties

Compound Namemethyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate
PubChem CID178078879
Molecular FormulaC21H17FN4O2
Molecular Weight376.39 g/mol
Exact Mass376.13
IUPAC Namemethyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate
SMILESCOC(=O)NCc1ccc2c(-c3ccncc3)c(-c3ccc(F)cc3)nn2c1
InChIInChI=1S/C21H17FN4O2/c1-28-21(27)24-12-14-2-7-18-19(15-8-10-23-11-9-15)20(25-26(18)13-14)16-3-5-17(22)6-4-16/h2-11,13H,12H2,1H3,(H,24,27)
InChIKeyAXZZWMDLQYZJRE-UHFFFAOYSA-N
XLogP4.06
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methylamino]propanoic acid
CID 178078983
(2R)-2-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methylamino]propanoic acid
CID 178079113
6-(cyclopropylmethyl)-2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178078966
6-bromo-2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178078886
2-(4-fluorophenyl)-6-[[(3R)-3-methylpiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178079066
2-amino-2-[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]ethane-1,1,1-triol
CID 178079030
2-(4-fluorophenyl)-N-piperidin-4-yl-3-pyridin-4-ylpyrazolo[1,5-a]pyridine-6-carboxamide
CID 178079061
2-(4-fluorophenyl)-6-[[(3S)-3-fluoropiperazin-1-yl]methyl]-3-pyridin-4-ylpyrazolo[1,5-a]pyridine
CID 178078968
2-(2,4-difluorophenyl)-1-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methylamino]-3-(tetrazol-1-yl)propan-2-ol
CID 171811753
[2-(4-chlorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methanamine
CID 178078943
6-fluoro-2-(4-fluorophenyl)-3-(2-methyl-4-pyridinyl)pyrazolo[1,5-a]pyridine
CID 178078910
N-[3-(4-fluorophenyl)-1-methyl-4-pyridin-4-ylpyrazol-5-yl]-2-(4-methoxyphenyl)acetamide
CID 18674002

Frequently Asked Questions

What is the IUPAC name of methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate?
The IUPAC name of methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate (CID 178078879) is methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate.
What is the SMILES notation for methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate?
The canonical SMILES for methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate is COC(=O)NCc1ccc2c(-c3ccncc3)c(-c3ccc(F)cc3)nn2c1.
What is the InChIKey of methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate?
The InChIKey is AXZZWMDLQYZJRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O2/c1-28-21(27)24-12-14-2-7-18-19(15-8-10-23-11-9-15)20(25-26(18)13-14)16-3-5-17(22)6-4-16/h2-11,13H,12H2,1H3,(H,24,27).
What are the key properties of methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate?
methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate has a molecular weight of 376.39 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[[2-(4-fluorophenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyridin-6-yl]methyl]carbamate is sourced from PubChem (CID 178078879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).