2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone

C15H15ClN4O — CID 103124801

IUPAC2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
SMILESCCc1nn(C)c(CC(=O)c2cnn3ccccc23)c1Cl
InChIInChI=1S/C15H15ClN4O/c1-3-11-15(16)13(19(2)18-11)8-14(21)10-9-17-20-7-5-4-6-12(10)20/h4-7,9H,3,8H2,1-2H3
InChIKeyZNKQSWBUBGKTPQ-UHFFFAOYSA-N
MW302.76 g/mol
LogP2.71
Rot. Bonds4

About 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone

2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone (PubChem CID 103124801) has the molecular formula C15H15ClN4O and a molecular weight of 302.76 g/mol. Its IUPAC name is 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone.

Molecular Properties

Compound Name2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
PubChem CID103124801
Molecular FormulaC15H15ClN4O
Molecular Weight302.76 g/mol
Exact Mass302.09
IUPAC Name2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
SMILESCCc1nn(C)c(CC(=O)c2cnn3ccccc23)c1Cl
InChIInChI=1S/C15H15ClN4O/c1-3-11-15(16)13(19(2)18-11)8-14(21)10-9-17-20-7-5-4-6-12(10)20/h4-7,9H,3,8H2,1-2H3
InChIKeyZNKQSWBUBGKTPQ-UHFFFAOYSA-N
XLogP2.71
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.76
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-bromo-1,3-dimethylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
CID 103124830
2-(2,3-dichlorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
CID 107311580
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(2,3-difluorophenyl)ethanone
CID 114980424
1-(5-bromo-2-chlorophenyl)-2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)ethanone
CID 114980376
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(2,4-dibromophenyl)ethanone
CID 107944570
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(2,5-dibromothiophen-3-yl)ethanone
CID 107967652
1-(2-bromo-3,4-difluorophenyl)-2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)ethanone
CID 107538202
1-(2-amino-4-bromophenyl)-2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)ethanone
CID 116591953
2-(2-chloro-4-fluorophenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone
CID 103124247
1-(4-chlorophenyl)-3-pyrazolo[1,5-a]pyridin-3-ylpropane-1,3-dione
CID 103119116
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-(5-ethylfuran-2-yl)ethanone
CID 114980388
(4-chloro-1-propylpyrazol-5-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
CID 103125383

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone?
The IUPAC name of 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone (CID 103124801) is 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone.
What is the SMILES notation for 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone?
The canonical SMILES for 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone is CCc1nn(C)c(CC(=O)c2cnn3ccccc23)c1Cl.
What is the InChIKey of 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone?
The InChIKey is ZNKQSWBUBGKTPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN4O/c1-3-11-15(16)13(19(2)18-11)8-14(21)10-9-17-20-7-5-4-6-12(10)20/h4-7,9H,3,8H2,1-2H3.
What are the key properties of 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone?
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone has a molecular weight of 302.76 g/mol, XLogP of 2.71, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanone is sourced from PubChem (CID 103124801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).