7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one

C16H16N4O2 — CID 129165324

IUPAC7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one
SMILESO=c1cc2n(cc1O)CCN(Cc1[nH]nc3ccccc13)C2
InChIInChI=1S/C16H16N4O2/c21-15-7-11-8-19(5-6-20(11)10-16(15)22)9-14-12-3-1-2-4-13(12)17-18-14/h1-4,7,10,22H,5-6,8-9H2,(H,17,18)
InChIKeyGQSJIXIUJXAHRY-UHFFFAOYSA-N
MW296.33 g/mol
LogP1.45
Rot. Bonds2

About 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one

7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one (PubChem CID 129165324) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one.

Molecular Properties

Compound Name7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one
PubChem CID129165324
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC Name7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one
SMILESO=c1cc2n(cc1O)CCN(Cc1[nH]nc3ccccc13)C2
InChIInChI=1S/C16H16N4O2/c21-15-7-11-8-19(5-6-20(11)10-16(15)22)9-14-12-3-1-2-4-13(12)17-18-14/h1-4,7,10,22H,5-6,8-9H2,(H,17,18)
InChIKeyGQSJIXIUJXAHRY-UHFFFAOYSA-N
XLogP1.45
TPSA74.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one?
The IUPAC name of 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one (CID 129165324) is 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one.
What is the SMILES notation for 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one?
The canonical SMILES for 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one is O=c1cc2n(cc1O)CCN(Cc1[nH]nc3ccccc13)C2.
What is the InChIKey of 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one?
The InChIKey is GQSJIXIUJXAHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c21-15-7-11-8-19(5-6-20(11)10-16(15)22)9-14-12-3-1-2-4-13(12)17-18-14/h1-4,7,10,22H,5-6,8-9H2,(H,17,18).
What are the key properties of 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one?
7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one has a molecular weight of 296.33 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-2-(2H-indazol-3-ylmethyl)-3,4-dihydro-1H-pyrido[1,2-a]pyrazin-8-one is sourced from PubChem (CID 129165324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).