6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride

C12H20Cl2N4O — CID 119874185

IUPAC6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride
SMILESCl.Cl.O=C([C@H]1CCCCN1)N1CCn2ccnc2C1
InChIInChI=1S/C12H18N4O.2ClH/c17-12(10-3-1-2-4-13-10)16-8-7-15-6-5-14-11(15)9-16;;/h5-6,10,13H,1-4,7-9H2;2*1H/t10-;;/m1../s1
InChIKeyJYYQHNNRGPZNHM-YQFADDPSSA-N
MW307.23 g/mol
LogP1.21
Rot. Bonds1

About 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride (PubChem CID 119874185) has the molecular formula C12H20Cl2N4O and a molecular weight of 307.23 g/mol. Its IUPAC name is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride.

Molecular Properties

Compound Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride
PubChem CID119874185
Molecular FormulaC12H20Cl2N4O
Molecular Weight307.23 g/mol
Exact Mass306.10
IUPAC Name6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride
SMILESCl.Cl.O=C([C@H]1CCCCN1)N1CCn2ccnc2C1
InChIInChI=1S/C12H18N4O.2ClH/c17-12(10-3-1-2-4-13-10)16-8-7-15-6-5-14-11(15)9-16;;/h5-6,10,13H,1-4,7-9H2;2*1H/t10-;;/m1../s1
InChIKeyJYYQHNNRGPZNHM-YQFADDPSSA-N
XLogP1.21
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.23
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride?
The IUPAC name of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride (CID 119874185) is 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride.
What is the SMILES notation for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride?
The canonical SMILES for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride is Cl.Cl.O=C([C@H]1CCCCN1)N1CCn2ccnc2C1.
What is the InChIKey of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride?
The InChIKey is JYYQHNNRGPZNHM-YQFADDPSSA-N. The full InChI is InChI=1S/C12H18N4O.2ClH/c17-12(10-3-1-2-4-13-10)16-8-7-15-6-5-14-11(15)9-16;;/h5-6,10,13H,1-4,7-9H2;2*1H/t10-;;/m1../s1.
What are the key properties of 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride?
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride has a molecular weight of 307.23 g/mol, XLogP of 1.21, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-[(2R)-piperidin-2-yl]methanone;dihydrochloride is sourced from PubChem (CID 119874185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).