N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine

C12H14N6 — CID 102806017

IUPACN-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cc2c(Nc3cn(C)nc3C)nccn2n1
InChIInChI=1S/C12H14N6/c1-8-6-11-12(13-4-5-18(11)15-8)14-10-7-17(3)16-9(10)2/h4-7H,1-3H3,(H,13,14)
InChIKeyVKJJDBHNFBWMLK-UHFFFAOYSA-N
MW242.29 g/mol
LogP1.82
Rot. Bonds2

About N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine

N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine (PubChem CID 102806017) has the molecular formula C12H14N6 and a molecular weight of 242.29 g/mol. Its IUPAC name is N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine.

Molecular Properties

Compound NameN-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
PubChem CID102806017
Molecular FormulaC12H14N6
Molecular Weight242.29 g/mol
Exact Mass242.13
IUPAC NameN-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine
SMILESCc1cc2c(Nc3cn(C)nc3C)nccn2n1
InChIInChI=1S/C12H14N6/c1-8-6-11-12(13-4-5-18(11)15-8)14-10-7-17(3)16-9(10)2/h4-7H,1-3H3,(H,13,14)
InChIKeyVKJJDBHNFBWMLK-UHFFFAOYSA-N
XLogP1.82
TPSA60.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The IUPAC name of N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine (CID 102806017) is N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine.
What is the SMILES notation for N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The canonical SMILES for N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine is Cc1cc2c(Nc3cn(C)nc3C)nccn2n1.
What is the InChIKey of N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
The InChIKey is VKJJDBHNFBWMLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6/c1-8-6-11-12(13-4-5-18(11)15-8)14-10-7-17(3)16-9(10)2/h4-7H,1-3H3,(H,13,14).
What are the key properties of N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine?
N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine has a molecular weight of 242.29 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dimethylpyrazol-4-yl)-2-methylpyrazolo[1,5-a]pyrazin-4-amine is sourced from PubChem (CID 102806017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).