4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine

C16H17ClN6 — CID 133490284

IUPAC4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
SMILESCc1cc2c(N3CCN(c4ncccc4Cl)CC3)nccn2n1
InChIInChI=1S/C16H17ClN6/c1-12-11-14-16(19-5-6-23(14)20-12)22-9-7-21(8-10-22)15-13(17)3-2-4-18-15/h2-6,11H,7-10H2,1H3
InChIKeyRWVPOCLFFKCHLK-UHFFFAOYSA-N
MW328.81 g/mol
LogP2.41
Rot. Bonds2

About 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine

4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine (PubChem CID 133490284) has the molecular formula C16H17ClN6 and a molecular weight of 328.81 g/mol. Its IUPAC name is 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
PubChem CID133490284
Molecular FormulaC16H17ClN6
Molecular Weight328.81 g/mol
Exact Mass328.12
IUPAC Name4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
SMILESCc1cc2c(N3CCN(c4ncccc4Cl)CC3)nccn2n1
InChIInChI=1S/C16H17ClN6/c1-12-11-14-16(19-5-6-23(14)20-12)22-9-7-21(8-10-22)15-13(17)3-2-4-18-15/h2-6,11H,7-10H2,1H3
InChIKeyRWVPOCLFFKCHLK-UHFFFAOYSA-N
XLogP2.41
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.81
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(3-bromo-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 166601620
4-[3-[(3-chloro-2-pyridinyl)oxymethyl]piperidin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 163352971
4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine
CID 133487949
1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-one
CID 104730047
4-(4-benzhydrylpiperazin-1-yl)-2-methylpyrazolo[1,5-a]pyrazine
CID 133487929
4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 133487895
4-[2-methyl-6-[4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 155800928
N,N-dimethyl-2-[4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]pyrimidin-4-amine
CID 155800620
4-(3-chloropyrrolidin-1-yl)-2-methylpyrazolo[1,5-a]pyrazine
CID 104733876
2-[4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 133488828
2-[4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]propanethioamide
CID 104730039
4-chloro-2-methylpyrazolo[1,5-a]pyrazine
CID 55264761

Frequently Asked Questions

What is the IUPAC name of 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
The IUPAC name of 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine (CID 133490284) is 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
The canonical SMILES for 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine is Cc1cc2c(N3CCN(c4ncccc4Cl)CC3)nccn2n1.
What is the InChIKey of 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
The InChIKey is RWVPOCLFFKCHLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN6/c1-12-11-14-16(19-5-6-23(14)20-12)22-9-7-21(8-10-22)15-13(17)3-2-4-18-15/h2-6,11H,7-10H2,1H3.
What are the key properties of 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine has a molecular weight of 328.81 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 133490284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).