8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one

C11H16N2O — CID 172614504

IUPAC8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one
SMILESCC(C)c1cc2n(c(=O)c1)CCNC2
InChIInChI=1S/C11H16N2O/c1-8(2)9-5-10-7-12-3-4-13(10)11(14)6-9/h5-6,8,12H,3-4,7H2,1-2H3
InChIKeyVSNBHVDLUWJSDA-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.07
Rot. Bonds1

About 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one

8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one (PubChem CID 172614504) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one.

Molecular Properties

Compound Name8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one
PubChem CID172614504
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one
SMILESCC(C)c1cc2n(c(=O)c1)CCNC2
InChIInChI=1S/C11H16N2O/c1-8(2)9-5-10-7-12-3-4-13(10)11(14)6-9/h5-6,8,12H,3-4,7H2,1-2H3
InChIKeyVSNBHVDLUWJSDA-UHFFFAOYSA-N
XLogP1.07
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one?
The IUPAC name of 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one (CID 172614504) is 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one.
What is the SMILES notation for 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one?
The canonical SMILES for 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one is CC(C)c1cc2n(c(=O)c1)CCNC2.
What is the InChIKey of 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one?
The InChIKey is VSNBHVDLUWJSDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8(2)9-5-10-7-12-3-4-13(10)11(14)6-9/h5-6,8,12H,3-4,7H2,1-2H3.
What are the key properties of 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one?
8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one has a molecular weight of 192.26 g/mol, XLogP of 1.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yl-1,2,3,4-tetrahydropyrido[1,2-a]pyrazin-6-one is sourced from PubChem (CID 172614504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).