1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one

C11H15N3O — CID 73439555

IUPAC1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one
SMILESCCC(=O)N1CCCC1c1cnccn1
InChIInChI=1S/C11H15N3O/c1-2-11(15)14-7-3-4-10(14)9-8-12-5-6-13-9/h5-6,8,10H,2-4,7H2,1H3
InChIKeyAHSFDAIVZUMQNH-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.55
Rot. Bonds2

About 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one

1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one (PubChem CID 73439555) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one.

Molecular Properties

Compound Name1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one
PubChem CID73439555
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one
SMILESCCC(=O)N1CCCC1c1cnccn1
InChIInChI=1S/C11H15N3O/c1-2-11(15)14-7-3-4-10(14)9-8-12-5-6-13-9/h5-6,8,10H,2-4,7H2,1H3
InChIKeyAHSFDAIVZUMQNH-UHFFFAOYSA-N
XLogP1.55
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 73438981
2,2-dimethyl-1-[(2R)-2-pyrazin-2-ylpiperidin-1-yl]propan-1-one
CID 95843127
2,2-dimethyl-1-[(2S)-2-pyrazin-2-ylpiperidin-1-yl]propan-1-one
CID 95843128
4-imidazol-1-yl-1-[(2S)-2-pyrazin-2-ylpyrrolidin-1-yl]butan-1-one
CID 124943315
2-[methyl(pyridin-3-ylmethyl)amino]-1-[(2R)-2-pyrazin-2-ylpyrrolidin-1-yl]ethanone
CID 124977060
(2-ethoxy-3-pyridinyl)-[(2R)-2-pyrazin-2-ylpyrrolidin-1-yl]methanone
CID 125022626
(E)-3-phenyl-1-[(2R)-2-pyrazin-2-ylpyrrolidin-1-yl]prop-2-en-1-one
CID 125005357
N,N-dimethyl-2-[(2S)-2-pyrazin-2-ylpyrrolidin-1-yl]acetamide
CID 95841666
3-(2,3-dihydroindol-1-yl)-1-[(2S)-2-pyrazin-2-ylpyrrolidin-1-yl]propan-1-one
CID 124960482
[(2S)-2-pyrazin-2-ylpyrrolidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 95841727
(6-methoxy-3-pyridinyl)-[(2R)-2-pyrazin-2-ylpyrrolidin-1-yl]methanone
CID 124968333

Frequently Asked Questions

What is the IUPAC name of 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one?
The IUPAC name of 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one (CID 73439555) is 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one.
What is the SMILES notation for 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one?
The canonical SMILES for 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one is CCC(=O)N1CCCC1c1cnccn1.
What is the InChIKey of 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one?
The InChIKey is AHSFDAIVZUMQNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-2-11(15)14-7-3-4-10(14)9-8-12-5-6-13-9/h5-6,8,10H,2-4,7H2,1H3.
What are the key properties of 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one?
1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one has a molecular weight of 205.26 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-pyrazin-2-ylpyrrolidin-1-yl)propan-1-one is sourced from PubChem (CID 73439555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).