2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride

C13H23Cl2N5O — CID 154910440

IUPAC2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride
SMILESCc1cc2n(n1)CCN(CC(=O)N1CCNCC1)C2.Cl.Cl
InChIInChI=1S/C13H21N5O.2ClH/c1-11-8-12-9-16(6-7-18(12)15-11)10-13(19)17-4-2-14-3-5-17;;/h8,14H,2-7,9-10H2,1H3;2*1H
InChIKeyCGWDRWDMRLNWTJ-UHFFFAOYSA-N
MW336.27 g/mol
LogP0.28
Rot. Bonds2

About 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride

2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride (PubChem CID 154910440) has the molecular formula C13H23Cl2N5O and a molecular weight of 336.27 g/mol. Its IUPAC name is 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride.

Molecular Properties

Compound Name2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride
PubChem CID154910440
Molecular FormulaC13H23Cl2N5O
Molecular Weight336.27 g/mol
Exact Mass335.13
IUPAC Name2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride
SMILESCc1cc2n(n1)CCN(CC(=O)N1CCNCC1)C2.Cl.Cl
InChIInChI=1S/C13H21N5O.2ClH/c1-11-8-12-9-16(6-7-18(12)15-11)10-13(19)17-4-2-14-3-5-17;;/h8,14H,2-7,9-10H2,1H3;2*1H
InChIKeyCGWDRWDMRLNWTJ-UHFFFAOYSA-N
XLogP0.28
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.27
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride with MolForge

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Related Compounds

2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-1-piperazin-1-ylethanone
CID 64576669
4-(2-oxo-2-piperazin-1-ylethyl)piperazine-2,6-dione
CID 66084891
1-piperazin-1-yl-2-pyrrolidin-1-ylethanone
CID 13057079
(2,5-dimethylpyrazol-3-yl)-piperazin-1-ylmethanone;hydrochloride
CID 119402592
2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-phenylethanol
CID 91835285
2-(3,5-diethylpyrazol-1-yl)-1-piperazin-1-ylethanone
CID 82694012
2-methyl-1-[2-(piperazin-1-ylmethyl)-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl]propan-1-one
CID 177354703
1-piperazin-1-yl-2-(4-pyridin-2-ylpiperazin-1-yl)ethanone;dihydrochloride
CID 119402906
2-(benzotriazol-2-yl)-1-piperazin-1-ylethanone
CID 83968777
4-methyl-1-(2-oxo-2-piperazin-1-ylethyl)pyrimidin-2-one
CID 114217405
(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-[5-(pyrrolidin-3-ylmethyl)-3-pyridinyl]methanone;hydrochloride
CID 171711105
2-[4-(4-acetylphenyl)piperazin-1-yl]-1-piperazin-1-ylethanone
CID 143404062

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride?
The IUPAC name of 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride (CID 154910440) is 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride.
What is the SMILES notation for 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride?
The canonical SMILES for 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride is Cc1cc2n(n1)CCN(CC(=O)N1CCNCC1)C2.Cl.Cl.
What is the InChIKey of 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride?
The InChIKey is CGWDRWDMRLNWTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O.2ClH/c1-11-8-12-9-16(6-7-18(12)15-11)10-13(19)17-4-2-14-3-5-17;;/h8,14H,2-7,9-10H2,1H3;2*1H.
What are the key properties of 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride?
2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride has a molecular weight of 336.27 g/mol, XLogP of 0.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)-1-piperazin-1-ylethanone;dihydrochloride is sourced from PubChem (CID 154910440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).