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

C15H19N5O — CID 97467498

IUPAC2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
SMILESO=C(CC1CC1)N1CCn2cc(Cn3cccn3)nc2C1
InChIInChI=1S/C15H19N5O/c21-15(8-12-2-3-12)19-7-6-18-9-13(17-14(18)11-19)10-20-5-1-4-16-20/h1,4-5,9,12H,2-3,6-8,10-11H2
InChIKeyPUFIFVYEENTNPP-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.27
Rot. Bonds4

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

2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone (PubChem CID 97467498) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone.

Molecular Properties

Compound Name2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
PubChem CID97467498
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone
SMILESO=C(CC1CC1)N1CCn2cc(Cn3cccn3)nc2C1
InChIInChI=1S/C15H19N5O/c21-15(8-12-2-3-12)19-7-6-18-9-13(17-14(18)11-19)10-20-5-1-4-16-20/h1,4-5,9,12H,2-3,6-8,10-11H2
InChIKeyPUFIFVYEENTNPP-UHFFFAOYSA-N
XLogP1.27
TPSA55.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
The IUPAC name of 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone (CID 97467498) is 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone.
What is the SMILES notation for 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
The canonical SMILES for 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone is O=C(CC1CC1)N1CCn2cc(Cn3cccn3)nc2C1.
What is the InChIKey of 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
The InChIKey is PUFIFVYEENTNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c21-15(8-12-2-3-12)19-7-6-18-9-13(17-14(18)11-19)10-20-5-1-4-16-20/h1,4-5,9,12H,2-3,6-8,10-11H2.
What are the key properties of 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone?
2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone has a molecular weight of 285.35 g/mol, XLogP of 1.27, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-[2-(pyrazol-1-ylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]ethanone is sourced from PubChem (CID 97467498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).