5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C19H16F2N4O2 — CID 67973857

IUPAC5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCc1cc(N2CCn3nc(COc4ccc(F)cc4)cc3C2=O)ncc1F
InChIInChI=1S/C19H16F2N4O2/c1-12-8-18(22-10-16(12)21)24-6-7-25-17(19(24)26)9-14(23-25)11-27-15-4-2-13(20)3-5-15/h2-5,8-10H,6-7,11H2,1H3
InChIKeyJINULQMQMPWRFD-UHFFFAOYSA-N
MW370.36 g/mol
LogP3.10
Rot. Bonds4

About 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 67973857) has the molecular formula C19H16F2N4O2 and a molecular weight of 370.36 g/mol. Its IUPAC name is 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID67973857
Molecular FormulaC19H16F2N4O2
Molecular Weight370.36 g/mol
Exact Mass370.12
IUPAC Name5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCc1cc(N2CCn3nc(COc4ccc(F)cc4)cc3C2=O)ncc1F
InChIInChI=1S/C19H16F2N4O2/c1-12-8-18(22-10-16(12)21)24-6-7-25-17(19(24)26)9-14(23-25)11-27-15-4-2-13(20)3-5-15/h2-5,8-10H,6-7,11H2,1H3
InChIKeyJINULQMQMPWRFD-UHFFFAOYSA-N
XLogP3.10
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.36
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one with MolForge

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Related Compounds

[5-(4-Methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](morpholin-4-yl)methanone
CID 1046563
N-(2-{[(4-Ethoxyphenyl)carbonyl]amino}ethyl)-1-pyridin-2-yl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide
CID 46884950
5-(5-Methyl-2-pyridinyl)-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 67973635
5-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
CID 67973779
5-(5-Methoxy-2-pyridinyl)-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 67974348
5-(5-fluoropyridin-2-yl)-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 67974411
5-(5-Fluoropyrimidin-2-yl)-2-(phenoxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 67974471
2-(Phenoxymethyl)-5-pyridin-2-yl-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 67974497
5-(4-Fluorophenyl)-2-(pyridin-4-yloxymethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 67976002
2-[(3-Fluorophenoxy)methyl]-5-(5-fluoro-2-pyridinyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
CID 70654545
1-{[1-(3-fluorophenyl)-3-(5-methyl-2-furyl)-1H-pyrazol-4-yl]methyl}-4-pyridin-2-ylpiperazine
CID 16187231
[1-methyl-6-(pyridin-2-ylmethoxy)pyrazolo[5,4-b]pyridin-3-yl]-[(2R)-2-methylpyrrolidin-1-yl]methanone
CID 76321786

Frequently Asked Questions

What is the IUPAC name of 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 67973857) is 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is Cc1cc(N2CCn3nc(COc4ccc(F)cc4)cc3C2=O)ncc1F.
What is the InChIKey of 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is JINULQMQMPWRFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4O2/c1-12-8-18(22-10-16(12)21)24-6-7-25-17(19(24)26)9-14(23-25)11-27-15-4-2-13(20)3-5-15/h2-5,8-10H,6-7,11H2,1H3.
What are the key properties of 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 370.36 g/mol, XLogP of 3.10, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-fluoro-4-methyl-2-pyridinyl)-2-[(4-fluorophenoxy)methyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 67973857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).