1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one

C10H15N3O — CID 131057360

IUPAC1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one
SMILESO=c1cnccn1CCC1CCNC1
InChIInChI=1S/C10H15N3O/c14-10-8-12-4-6-13(10)5-2-9-1-3-11-7-9/h4,6,8-9,11H,1-3,5,7H2
InChIKeyGSKDKQHBZYMUGR-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.24
Rot. Bonds3

About 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one

1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one (PubChem CID 131057360) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one.

Molecular Properties

Compound Name1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one
PubChem CID131057360
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one
SMILESO=c1cnccn1CCC1CCNC1
InChIInChI=1S/C10H15N3O/c14-10-8-12-4-6-13(10)5-2-9-1-3-11-7-9/h4,6,8-9,11H,1-3,5,7H2
InChIKeyGSKDKQHBZYMUGR-UHFFFAOYSA-N
XLogP0.24
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[(2S)-pyrrolidin-2-yl]methyl]pyrazin-2-one
CID 130538529
1-[[(2R)-pyrrolidin-2-yl]methyl]pyrazin-2-one
CID 130538533
1-(Pyrrolidin-3-ylmethyl)pyrazin-2-one
CID 130538536
1-[(5-Oxopyrrolidin-3-yl)methyl]pyrazin-2-one
CID 130961455
1-[(3-Aminocyclobutyl)methyl]-1,2-dihydropyrazin-2-one
CID 164653859

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one?
The IUPAC name of 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one (CID 131057360) is 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one.
What is the SMILES notation for 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one?
The canonical SMILES for 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one is O=c1cnccn1CCC1CCNC1.
What is the InChIKey of 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one?
The InChIKey is GSKDKQHBZYMUGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-10-8-12-4-6-13(10)5-2-9-1-3-11-7-9/h4,6,8-9,11H,1-3,5,7H2.
What are the key properties of 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one?
1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one has a molecular weight of 193.25 g/mol, XLogP of 0.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyrrolidin-3-ylethyl)pyrazin-2-one is sourced from PubChem (CID 131057360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).