3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one

C10H15N3O — CID 166162659

IUPAC3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one
SMILESCc1nccn([C@@H]2CCCNC2)c1=O
InChIInChI=1S/C10H15N3O/c1-8-10(14)13(6-5-12-8)9-3-2-4-11-7-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m1/s1
InChIKeyADKKVODXIRCWGJ-SECBINFHSA-N
MW193.25 g/mol
LogP0.48
Rot. Bonds1

About 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one

3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one (PubChem CID 166162659) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one.

Molecular Properties

Compound Name3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one
PubChem CID166162659
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one
SMILESCc1nccn([C@@H]2CCCNC2)c1=O
InChIInChI=1S/C10H15N3O/c1-8-10(14)13(6-5-12-8)9-3-2-4-11-7-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m1/s1
InChIKeyADKKVODXIRCWGJ-SECBINFHSA-N
XLogP0.48
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one?
The IUPAC name of 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one (CID 166162659) is 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one.
What is the SMILES notation for 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one?
The canonical SMILES for 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one is Cc1nccn([C@@H]2CCCNC2)c1=O.
What is the InChIKey of 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one?
The InChIKey is ADKKVODXIRCWGJ-SECBINFHSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-10(14)13(6-5-12-8)9-3-2-4-11-7-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m1/s1.
What are the key properties of 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one?
3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one has a molecular weight of 193.25 g/mol, XLogP of 0.48, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one is sourced from PubChem (CID 166162659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).