4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine

C19H24N6O — CID 175650476

IUPAC4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
SMILESCOc1cccc(CN2CCN(c3nccn4nc(C)cc34)CC2C)n1
InChIInChI=1S/C19H24N6O/c1-14-11-17-19(20-7-8-25(17)22-14)24-10-9-23(15(2)12-24)13-16-5-4-6-18(21-16)26-3/h4-8,11,15H,9-10,12-13H2,1-3H3
InChIKeyBGLPNQWNFWVHPS-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.15
Rot. Bonds4

About 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine

4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine (PubChem CID 175650476) has the molecular formula C19H24N6O and a molecular weight of 352.44 g/mol. Its IUPAC name is 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
PubChem CID175650476
Molecular FormulaC19H24N6O
Molecular Weight352.44 g/mol
Exact Mass352.20
IUPAC Name4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
SMILESCOc1cccc(CN2CCN(c3nccn4nc(C)cc34)CC2C)n1
InChIInChI=1S/C19H24N6O/c1-14-11-17-19(20-7-8-25(17)22-14)24-10-9-23(15(2)12-24)13-16-5-4-6-18(21-16)26-3/h4-8,11,15H,9-10,12-13H2,1-3H3
InChIKeyBGLPNQWNFWVHPS-UHFFFAOYSA-N
XLogP2.15
TPSA58.79 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

2-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]quinoxaline
CID 172892521
3-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]pyridine-2-carbonitrile
CID 172901321
6-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 172892401
4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 133487895
4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 133490284
2-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]imidazo[1,2-a]pyridine
CID 172903088
2-methyl-4-(3-pyrazol-1-ylpyrrolidin-1-yl)pyrazolo[1,5-a]pyrazine
CID 126946467
4-(3-chloropyrrolidin-1-yl)-2-methylpyrazolo[1,5-a]pyrazine
CID 104733876
4-[4-(3-bromo-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 166601620
5-[[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]methyl]-3-methyl-1,2,4-oxadiazole
CID 172900745
4-[3-[(3-chloro-2-pyridinyl)oxymethyl]piperidin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 163352971
1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-one
CID 104730047

Frequently Asked Questions

What is the IUPAC name of 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
The IUPAC name of 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine (CID 175650476) is 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
The canonical SMILES for 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine is COc1cccc(CN2CCN(c3nccn4nc(C)cc34)CC2C)n1.
What is the InChIKey of 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
The InChIKey is BGLPNQWNFWVHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6O/c1-14-11-17-19(20-7-8-25(17)22-14)24-10-9-23(15(2)12-24)13-16-5-4-6-18(21-16)26-3/h4-8,11,15H,9-10,12-13H2,1-3H3.
What are the key properties of 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine?
4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine has a molecular weight of 352.44 g/mol, XLogP of 2.15, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[(6-methoxy-2-pyridinyl)methyl]-3-methylpiperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 175650476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).