[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone

C15H20N6O — CID 97471184

IUPAC[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(N1CCCC1)N1CCn2c(Cn3cccn3)cnc2C1
InChIInChI=1S/C15H20N6O/c22-15(18-5-1-2-6-18)19-8-9-21-13(10-16-14(21)12-19)11-20-7-3-4-17-20/h3-4,7,10H,1-2,5-6,8-9,11-12H2
InChIKeyUOVWIBGAHICORA-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.16
Rot. Bonds2

About [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone

[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone (PubChem CID 97471184) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone
PubChem CID97471184
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC Name[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(N1CCCC1)N1CCn2c(Cn3cccn3)cnc2C1
InChIInChI=1S/C15H20N6O/c22-15(18-5-1-2-6-18)19-8-9-21-13(10-16-14(21)12-19)11-20-7-3-4-17-20/h3-4,7,10H,1-2,5-6,8-9,11-12H2
InChIKeyUOVWIBGAHICORA-UHFFFAOYSA-N
XLogP1.16
TPSA59.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone (CID 97471184) is [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone is O=C(N1CCCC1)N1CCn2c(Cn3cccn3)cnc2C1.
What is the InChIKey of [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is UOVWIBGAHICORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c22-15(18-5-1-2-6-18)19-8-9-21-13(10-16-14(21)12-19)11-20-7-3-4-17-20/h3-4,7,10H,1-2,5-6,8-9,11-12H2.
What are the key properties of [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone?
[3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 300.37 g/mol, XLogP of 1.16, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 97471184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).