2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine

C16H19N7 — CID 126916736

IUPAC2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1ccc(N2CC(CNc3nccn4nc(C)cc34)C2)nn1
InChIInChI=1S/C16H19N7/c1-11-3-4-15(20-19-11)22-9-13(10-22)8-18-16-14-7-12(2)21-23(14)6-5-17-16/h3-7,13H,8-10H2,1-2H3,(H,17,18)
InChIKeyFEYMNFVOBJXDPP-UHFFFAOYSA-N
MW309.38 g/mol
LogP1.68
Rot. Bonds4

About 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine

2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 126916736) has the molecular formula C16H19N7 and a molecular weight of 309.38 g/mol. Its IUPAC name is 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine
PubChem CID126916736
Molecular FormulaC16H19N7
Molecular Weight309.38 g/mol
Exact Mass309.17
IUPAC Name2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1ccc(N2CC(CNc3nccn4nc(C)cc34)C2)nn1
InChIInChI=1S/C16H19N7/c1-11-3-4-15(20-19-11)22-9-13(10-22)8-18-16-14-7-12(2)21-23(14)6-5-17-16/h3-7,13H,8-10H2,1-2H3,(H,17,18)
InChIKeyFEYMNFVOBJXDPP-UHFFFAOYSA-N
XLogP1.68
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine (CID 126916736) is 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine is Cc1ccc(N2CC(CNc3nccn4nc(C)cc34)C2)nn1.
What is the InChIKey of 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is FEYMNFVOBJXDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N7/c1-11-3-4-15(20-19-11)22-9-13(10-22)8-18-16-14-7-12(2)21-23(14)6-5-17-16/h3-7,13H,8-10H2,1-2H3,(H,17,18).
What are the key properties of 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine?
2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 309.38 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 126916736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).