pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone

C14H14N4O — CID 24631463

IUPACpyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
SMILESO=C(c1cnccn1)N1CCCC1c1ccncc1
InChIInChI=1S/C14H14N4O/c19-14(12-10-16-7-8-17-12)18-9-1-2-13(18)11-3-5-15-6-4-11/h3-8,10,13H,1-2,9H2
InChIKeyPUIXGTWCLZXXSH-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.85
Rot. Bonds2

About pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone

pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone (PubChem CID 24631463) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Namepyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
PubChem CID24631463
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Namepyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
SMILESO=C(c1cnccn1)N1CCCC1c1ccncc1
InChIInChI=1S/C14H14N4O/c19-14(12-10-16-7-8-17-12)18-9-1-2-13(18)11-3-5-15-6-4-11/h3-8,10,13H,1-2,9H2
InChIKeyPUIXGTWCLZXXSH-UHFFFAOYSA-N
XLogP1.85
TPSA58.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

pyrazin-2-yl-[2-[4-(trifluoromethyl)phenyl]pyrrolidin-1-yl]methanone
CID 110669963
(5-methylpyrazin-2-yl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 42942674
pyrazin-2-yl-[(2S)-2-pyrazin-2-ylpyrrolidin-1-yl]methanone
CID 124992078
[2-[4-(3-chlorophenyl)phenyl]pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 53379502
N-[[4-[1-(pyrazine-2-carbonyl)pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 110095597
[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 51253826
cyclobutyl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 42939217
pyrazin-2-yl-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 53192003
[(2R)-2-[(2S)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]-pyrazin-2-ylmethanone
CID 129461529
furan-3-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 24631497
4-oxo-4-(2-pyridin-4-ylpyrrolidin-1-yl)butanoic acid
CID 43578440
N,N-diethyl-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 110871633

Frequently Asked Questions

What is the IUPAC name of pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
The IUPAC name of pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone (CID 24631463) is pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone.
What is the SMILES notation for pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
The canonical SMILES for pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone is O=C(c1cnccn1)N1CCCC1c1ccncc1.
What is the InChIKey of pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
The InChIKey is PUIXGTWCLZXXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c19-14(12-10-16-7-8-17-12)18-9-1-2-13(18)11-3-5-15-6-4-11/h3-8,10,13H,1-2,9H2.
What are the key properties of pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone?
pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone has a molecular weight of 254.29 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazin-2-yl-(2-pyridin-4-ylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 24631463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).