2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone

C14H9Cl2N3O — CID 107311523

IUPAC2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
SMILESO=C(Cc1cccc(Cl)c1Cl)c1cnn2ccncc12
InChIInChI=1S/C14H9Cl2N3O/c15-11-3-1-2-9(14(11)16)6-13(20)10-7-18-19-5-4-17-8-12(10)19/h1-5,7-8H,6H2
InChIKeyCIVPRCUHHFTVBD-UHFFFAOYSA-N
MW306.15 g/mol
LogP3.46
Rot. Bonds3

About 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone

2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone (PubChem CID 107311523) has the molecular formula C14H9Cl2N3O and a molecular weight of 306.15 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
PubChem CID107311523
Molecular FormulaC14H9Cl2N3O
Molecular Weight306.15 g/mol
Exact Mass305.01
IUPAC Name2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
SMILESO=C(Cc1cccc(Cl)c1Cl)c1cnn2ccncc12
InChIInChI=1S/C14H9Cl2N3O/c15-11-3-1-2-9(14(11)16)6-13(20)10-7-18-19-5-4-17-8-12(10)19/h1-5,7-8H,6H2
InChIKeyCIVPRCUHHFTVBD-UHFFFAOYSA-N
XLogP3.46
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.15
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
CID 107311580
2-(2-chloro-4-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
CID 103124249
2-(2,6-difluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
CID 103125577
1-pyrazolo[1,5-a]pyrazin-3-ylbut-3-yn-1-one
CID 103123919
2-(2,5-dimethylphenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
CID 103124015
2-(2,3-dichlorophenyl)-1-(3-fluoro-4-pyridinyl)ethanone
CID 107307992
2-(1-methylpyrazol-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
CID 103124105
1-pyrazolo[1,5-a]pyrazin-3-ylbutan-1-one
CID 103123927
N-(2-amino-6-chlorophenyl)pyrazolo[1,5-a]pyrazine-3-carboxamide
CID 103116169
2-(3-bromothiophen-2-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone
CID 103124381
pyrazolo[1,5-a]pyrazine-3-carboxylic acid
CID 67123720
1-(2-chlorophenyl)-2-(2,3-dichlorophenyl)ethanone
CID 107307846

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone?
The IUPAC name of 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone (CID 107311523) is 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone?
The canonical SMILES for 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone is O=C(Cc1cccc(Cl)c1Cl)c1cnn2ccncc12.
What is the InChIKey of 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone?
The InChIKey is CIVPRCUHHFTVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2N3O/c15-11-3-1-2-9(14(11)16)6-13(20)10-7-18-19-5-4-17-8-12(10)19/h1-5,7-8H,6H2.
What are the key properties of 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone?
2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone has a molecular weight of 306.15 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone is sourced from PubChem (CID 107311523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).