(7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

C20H19FN4O2 — CID 122190333

IUPAC(7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCc1ccnc(OCc2cc3n(n2)[C@H](C)CN(c2ccc(F)cc2)C3=O)c1
InChIInChI=1S/C20H19FN4O2/c1-13-7-8-22-19(9-13)27-12-16-10-18-20(26)24(11-14(2)25(18)23-16)17-5-3-15(21)4-6-17/h3-10,14H,11-12H2,1-2H3/t14-/m1/s1
InChIKeyQMPKQXCCCBUHDD-CQSZACIVSA-N
MW366.40 g/mol
LogP3.53
Rot. Bonds4

About (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one

(7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (PubChem CID 122190333) has the molecular formula C20H19FN4O2 and a molecular weight of 366.40 g/mol. Its IUPAC name is (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name(7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
PubChem CID122190333
Molecular FormulaC20H19FN4O2
Molecular Weight366.40 g/mol
Exact Mass366.15
IUPAC Name(7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one
SMILESCc1ccnc(OCc2cc3n(n2)[C@H](C)CN(c2ccc(F)cc2)C3=O)c1
InChIInChI=1S/C20H19FN4O2/c1-13-7-8-22-19(9-13)27-12-16-10-18-20(26)24(11-14(2)25(18)23-16)17-5-3-15(21)4-6-17/h3-10,14H,11-12H2,1-2H3/t14-/m1/s1
InChIKeyQMPKQXCCCBUHDD-CQSZACIVSA-N
XLogP3.53
TPSA60.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one (CID 122190333) is (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is Cc1ccnc(OCc2cc3n(n2)[C@H](C)CN(c2ccc(F)cc2)C3=O)c1.
What is the InChIKey of (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is QMPKQXCCCBUHDD-CQSZACIVSA-N. The full InChI is InChI=1S/C20H19FN4O2/c1-13-7-8-22-19(9-13)27-12-16-10-18-20(26)24(11-14(2)25(18)23-16)17-5-3-15(21)4-6-17/h3-10,14H,11-12H2,1-2H3/t14-/m1/s1.
What are the key properties of (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one?
(7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 366.40 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-5-(4-fluorophenyl)-7-methyl-2-[(4-methyl-2-pyridinyl)oxymethyl]-6,7-dihydropyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 122190333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).