3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one

C20H14N6O2 — CID 154656464

IUPAC3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCn1ccc(-c2nc3[nH]c(=O)ccc3nc2-c2ccc3[nH]c(=O)ccc3c2)n1
InChIInChI=1S/C20H14N6O2/c1-26-9-8-14(25-26)19-18(22-15-5-7-17(28)23-20(15)24-19)12-2-4-13-11(10-12)3-6-16(27)21-13/h2-10H,1H3,(H,21,27)(H,23,24,28)
InChIKeyRGOVOWQPECCPIY-UHFFFAOYSA-N
MW370.37 g/mol
LogP2.23
Rot. Bonds2

About 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one

3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one (PubChem CID 154656464) has the molecular formula C20H14N6O2 and a molecular weight of 370.37 g/mol. Its IUPAC name is 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one
PubChem CID154656464
Molecular FormulaC20H14N6O2
Molecular Weight370.37 g/mol
Exact Mass370.12
IUPAC Name3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCn1ccc(-c2nc3[nH]c(=O)ccc3nc2-c2ccc3[nH]c(=O)ccc3c2)n1
InChIInChI=1S/C20H14N6O2/c1-26-9-8-14(25-26)19-18(22-15-5-7-17(28)23-20(15)24-19)12-2-4-13-11(10-12)3-6-16(27)21-13/h2-10H,1H3,(H,21,27)(H,23,24,28)
InChIKeyRGOVOWQPECCPIY-UHFFFAOYSA-N
XLogP2.23
TPSA109.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.37
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one?
The IUPAC name of 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one (CID 154656464) is 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one.
What is the SMILES notation for 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one?
The canonical SMILES for 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one is Cn1ccc(-c2nc3[nH]c(=O)ccc3nc2-c2ccc3[nH]c(=O)ccc3c2)n1.
What is the InChIKey of 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one?
The InChIKey is RGOVOWQPECCPIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N6O2/c1-26-9-8-14(25-26)19-18(22-15-5-7-17(28)23-20(15)24-19)12-2-4-13-11(10-12)3-6-16(27)21-13/h2-10H,1H3,(H,21,27)(H,23,24,28).
What are the key properties of 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one?
3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one has a molecular weight of 370.37 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-3-yl)-2-(2-oxo-1H-quinolin-6-yl)-5H-pyrido[2,3-b]pyrazin-6-one is sourced from PubChem (CID 154656464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).