1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one

C19H17N5O2 — CID 74223830

IUPAC1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one
SMILESCc1cc(Oc2nccc3[nH]ncc23)ccc1-c1c(C)ncc(=O)n1C
InChIInChI=1S/C19H17N5O2/c1-11-8-13(26-19-15-9-22-23-16(15)6-7-20-19)4-5-14(11)18-12(2)21-10-17(25)24(18)3/h4-10H,1-3H3,(H,22,23)
InChIKeyPDMYGISUMGVGJZ-UHFFFAOYSA-N
MW347.38 g/mol
LogP3.13
Rot. Bonds3

About 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one

1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one (PubChem CID 74223830) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one.

Molecular Properties

Compound Name1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one
PubChem CID74223830
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Name1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one
SMILESCc1cc(Oc2nccc3[nH]ncc23)ccc1-c1c(C)ncc(=O)n1C
InChIInChI=1S/C19H17N5O2/c1-11-8-13(26-19-15-9-22-23-16(15)6-7-20-19)4-5-14(11)18-12(2)21-10-17(25)24(18)3/h4-10H,1-3H3,(H,22,23)
InChIKeyPDMYGISUMGVGJZ-UHFFFAOYSA-N
XLogP3.13
TPSA85.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one?
The IUPAC name of 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one (CID 74223830) is 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one.
What is the SMILES notation for 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one?
The canonical SMILES for 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one is Cc1cc(Oc2nccc3[nH]ncc23)ccc1-c1c(C)ncc(=O)n1C.
What is the InChIKey of 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one?
The InChIKey is PDMYGISUMGVGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-11-8-13(26-19-15-9-22-23-16(15)6-7-20-19)4-5-14(11)18-12(2)21-10-17(25)24(18)3/h4-10H,1-3H3,(H,22,23).
What are the key properties of 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one?
1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one has a molecular weight of 347.38 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-6-[2-methyl-4-(1H-pyrazolo[4,5-c]pyridin-4-yloxy)phenyl]pyrazin-2-one is sourced from PubChem (CID 74223830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).