3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one

C15H17N3O — CID 55143073

IUPAC3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one
SMILESO=C(CCN1CCn2ccnc2C1)c1ccccc1
InChIInChI=1S/C15H17N3O/c19-14(13-4-2-1-3-5-13)6-8-17-10-11-18-9-7-16-15(18)12-17/h1-5,7,9H,6,8,10-12H2
InChIKeyZZMRADNCEJNQRS-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.97
Rot. Bonds4

About 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one

3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one (PubChem CID 55143073) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one.

Molecular Properties

Compound Name3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one
PubChem CID55143073
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one
SMILESO=C(CCN1CCn2ccnc2C1)c1ccccc1
InChIInChI=1S/C15H17N3O/c19-14(13-4-2-1-3-5-13)6-8-17-10-11-18-9-7-16-15(18)12-17/h1-5,7,9H,6,8,10-12H2
InChIKeyZZMRADNCEJNQRS-UHFFFAOYSA-N
XLogP1.97
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one?
The IUPAC name of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one (CID 55143073) is 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one.
What is the SMILES notation for 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one?
The canonical SMILES for 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one is O=C(CCN1CCn2ccnc2C1)c1ccccc1.
What is the InChIKey of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one?
The InChIKey is ZZMRADNCEJNQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c19-14(13-4-2-1-3-5-13)6-8-17-10-11-18-9-7-16-15(18)12-17/h1-5,7,9H,6,8,10-12H2.
What are the key properties of 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one?
3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one has a molecular weight of 255.32 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-phenylpropan-1-one is sourced from PubChem (CID 55143073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).