7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine

C13H10F2N4O — CID 171798942

IUPAC7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine
SMILESCOc1ccc(-c2ccnc(C(F)F)n2)n2nccc12
InChIInChI=1S/C13H10F2N4O/c1-20-11-3-2-9(19-10(11)5-7-17-19)8-4-6-16-13(18-8)12(14)15/h2-7,12H,1H3
InChIKeyJRABPDBJCNKLSD-UHFFFAOYSA-N
MW276.25 g/mol
LogP2.74
Rot. Bonds3

About 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine

7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine (PubChem CID 171798942) has the molecular formula C13H10F2N4O and a molecular weight of 276.25 g/mol. Its IUPAC name is 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine
PubChem CID171798942
Molecular FormulaC13H10F2N4O
Molecular Weight276.25 g/mol
Exact Mass276.08
IUPAC Name7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine
SMILESCOc1ccc(-c2ccnc(C(F)F)n2)n2nccc12
InChIInChI=1S/C13H10F2N4O/c1-20-11-3-2-9(19-10(11)5-7-17-19)8-4-6-16-13(18-8)12(14)15/h2-7,12H,1H3
InChIKeyJRABPDBJCNKLSD-UHFFFAOYSA-N
XLogP2.74
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.25
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-7-methylpyrazolo[1,5-a]pyridine
CID 130065763
7-[5,6-bis(difluoromethyl)pyrazin-2-yl]-4-chloropyrazolo[1,5-a]pyridine
CID 178072762
4-methoxypyrazolo[1,5-a]pyridine-7-carboxylic acid
CID 155978082
(4S)-5-[[2-(difluoromethyl)-6-pyrazolo[1,5-a]pyrimidin-7-yl-3-pyridinyl]oxy]-2,4-dimethylpentan-2-amine
CID 135284477
2,4-bis(difluoromethyl)pyrimidine
CID 68586221
4-chloro-2-(difluoromethyl)pyrimidine
CID 118833547
2-amino-2-[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]ethanol
CID 116902164
3-(difluoromethyl)-4-methoxy-2-methylpyridine
CID 130097309
2-amino-1-[4-(2-methoxy-5-methylphenyl)pyrimidin-2-yl]ethanol
CID 116902239
2-[4-(3-bromo-4-methoxyphenyl)pyrimidin-2-yl]propan-1-amine
CID 116897844
3-(difluoromethyl)-2-iodo-4-methoxypyridine
CID 130096639
5-methoxy-4-methylpyrazolo[1,5-a]pyridine
CID 130065771

Frequently Asked Questions

What is the IUPAC name of 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine?
The IUPAC name of 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine (CID 171798942) is 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine is COc1ccc(-c2ccnc(C(F)F)n2)n2nccc12.
What is the InChIKey of 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine?
The InChIKey is JRABPDBJCNKLSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N4O/c1-20-11-3-2-9(19-10(11)5-7-17-19)8-4-6-16-13(18-8)12(14)15/h2-7,12H,1H3.
What are the key properties of 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine?
7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine has a molecular weight of 276.25 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(difluoromethyl)pyrimidin-4-yl]-4-methoxypyrazolo[1,5-a]pyridine is sourced from PubChem (CID 171798942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).