[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone

C16H22N6O — CID 97467328

IUPAC[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone
SMILESCCN(CC)Cc1cn2c(n1)CN(C(=O)c1cnccn1)CC2
InChIInChI=1S/C16H22N6O/c1-3-20(4-2)10-13-11-21-7-8-22(12-15(21)19-13)16(23)14-9-17-5-6-18-14/h5-6,9,11H,3-4,7-8,10,12H2,1-2H3
InChIKeyKWZNQFFXHRXKBX-UHFFFAOYSA-N
MW314.39 g/mol
LogP1.17
Rot. Bonds5

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

[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone (PubChem CID 97467328) has the molecular formula C16H22N6O and a molecular weight of 314.39 g/mol. Its IUPAC name is [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone.

Molecular Properties

Compound Name[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone
PubChem CID97467328
Molecular FormulaC16H22N6O
Molecular Weight314.39 g/mol
Exact Mass314.19
IUPAC Name[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone
SMILESCCN(CC)Cc1cn2c(n1)CN(C(=O)c1cnccn1)CC2
InChIInChI=1S/C16H22N6O/c1-3-20(4-2)10-13-11-21-7-8-22(12-15(21)19-13)16(23)14-9-17-5-6-18-14/h5-6,9,11H,3-4,7-8,10,12H2,1-2H3
InChIKeyKWZNQFFXHRXKBX-UHFFFAOYSA-N
XLogP1.17
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

Imidazo[1,2-a]pyrazine-2-carboxamide
CID 12674624
5H,10H-Diimidazo[1,5-a:1',5'-d]pyrazine-5,10-dione
CID 1051510
1,3-Dipropyl-8-pyrazin-2-yl-3,7-dihydro-purine-2,6-dione
CID 14000474
8-(1H-imidazol-1-yl)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
CID 653281
8-(3-imidazol-1-ylpropyl)-1,3-dimethyl-7,9-dihydro-6H-purino[7,8-a]pyrazine-2,4-dione
CID 155540193
Theophylline, 7-(3-(4-allyl-1-piperazinyl)propyl)-, dihydrochloride
CID 211498
6(1H)-Purinone, 2,3-dihydro-3,7-dimethyl-1-(2-(4-methylpiperazinyl)ethyl)-
CID 3057155
3-methyl-5H,6H,7H,8H-imidazo[1,5-a]pyrazin-8-one
CID 58970104
7-[3-[4-(3-Chloropyrazin-2-yl)piperazin-1-yl]propyl]-1,3-dimethylpurine-2,6-dione;hydrochloride
CID 45261919
7-[3-[4-(6-Chloropyrazin-2-yl)piperazin-1-yl]propyl]-1,3-dimethylpurine-2,6-dione;hydrochloride
CID 45265098
[4-[(1-Ethylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 53600135
[3-(2-Methylimidazol-1-yl)piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone
CID 53602141

Frequently Asked Questions

What is the IUPAC name of [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone?
The IUPAC name of [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone (CID 97467328) is [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone.
What is the SMILES notation for [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone?
The canonical SMILES for [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone is CCN(CC)Cc1cn2c(n1)CN(C(=O)c1cnccn1)CC2.
What is the InChIKey of [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone?
The InChIKey is KWZNQFFXHRXKBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N6O/c1-3-20(4-2)10-13-11-21-7-8-22(12-15(21)19-13)16(23)14-9-17-5-6-18-14/h5-6,9,11H,3-4,7-8,10,12H2,1-2H3.
What are the key properties of [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone?
[2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone has a molecular weight of 314.39 g/mol, XLogP of 1.17, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(diethylaminomethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyrazin-2-ylmethanone is sourced from PubChem (CID 97467328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).