1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone

C13H16N4O — CID 104730056

IUPAC1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone
SMILESCC(=O)C1CCN(c2nccn3nccc23)CC1
InChIInChI=1S/C13H16N4O/c1-10(18)11-3-7-16(8-4-11)13-12-2-5-15-17(12)9-6-14-13/h2,5-6,9,11H,3-4,7-8H2,1H3
InChIKeyLPZZGAKUQLQYTD-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.53
Rot. Bonds2

About 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone

1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone (PubChem CID 104730056) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone.

Molecular Properties

Compound Name1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone
PubChem CID104730056
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone
SMILESCC(=O)C1CCN(c2nccn3nccc23)CC1
InChIInChI=1S/C13H16N4O/c1-10(18)11-3-7-16(8-4-11)13-12-2-5-15-17(12)9-6-14-13/h2,5-6,9,11H,3-4,7-8H2,1H3
InChIKeyLPZZGAKUQLQYTD-UHFFFAOYSA-N
XLogP1.53
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)ethanone
CID 113446199
(1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidin-3-yl)-thiomorpholin-4-ylmethanone
CID 165435156
1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-3-carboxamide
CID 172899821
4-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)thiomorpholine
CID 171328024
1-(1-pyridin-2-ylpiperidin-4-yl)ethanone
CID 63845661
N,1-dimethyl-N-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methyl]imidazole-4-carboxamide
CID 172881779
4-[3-(bromomethyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 104734120
4-[4-(3-bromo-2-pyridinyl)piperazin-1-yl]pyrazolo[1,5-a]pyrazine
CID 166605461
4-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)methoxy]pyridine-2-carboxamide
CID 166603591
4-N-cyclopropyl-6-N,6-N-dimethyl-4-N-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)pyrimidine-4,6-diamine
CID 126891496
N'-hydroxy-2-(4-pyrazolo[1,5-a]pyrazin-4-ylpiperazin-1-yl)propanimidamide
CID 104730286
6-methyl-3-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 126910135

Frequently Asked Questions

What is the IUPAC name of 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone?
The IUPAC name of 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone (CID 104730056) is 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone.
What is the SMILES notation for 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone?
The canonical SMILES for 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone is CC(=O)C1CCN(c2nccn3nccc23)CC1.
What is the InChIKey of 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone?
The InChIKey is LPZZGAKUQLQYTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-10(18)11-3-7-16(8-4-11)13-12-2-5-15-17(12)9-6-14-13/h2,5-6,9,11H,3-4,7-8H2,1H3.
What are the key properties of 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone?
1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone has a molecular weight of 244.30 g/mol, XLogP of 1.53, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone is sourced from PubChem (CID 104730056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).