6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile

C20H17N9 — CID 72715617

IUPAC6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile
SMILESN#Cc1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)n1
InChIInChI=1S/C20H17N9/c21-9-15-12-23-13-17(26-15)16-8-18-14(10-24-16)11-25-29(18)20-3-1-2-19(27-20)28-6-4-22-5-7-28/h1-3,8,10-13,22H,4-7H2
InChIKeyINARDHYYJBOMKR-UHFFFAOYSA-N
MW383.42 g/mol
LogP1.55
Rot. Bonds3

About 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile

6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile (PubChem CID 72715617) has the molecular formula C20H17N9 and a molecular weight of 383.42 g/mol. Its IUPAC name is 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile
PubChem CID72715617
Molecular FormulaC20H17N9
Molecular Weight383.42 g/mol
Exact Mass383.16
IUPAC Name6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile
SMILESN#Cc1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)n1
InChIInChI=1S/C20H17N9/c21-9-15-12-23-13-17(26-15)16-8-18-14(10-24-16)11-25-29(18)20-3-1-2-19(27-20)28-6-4-22-5-7-28/h1-3,8,10-13,22H,4-7H2
InChIKeyINARDHYYJBOMKR-UHFFFAOYSA-N
XLogP1.55
TPSA108.44 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.42
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile?
The IUPAC name of 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile (CID 72715617) is 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile.
What is the SMILES notation for 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile?
The canonical SMILES for 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile is N#Cc1cncc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)n1.
What is the InChIKey of 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile?
The InChIKey is INARDHYYJBOMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N9/c21-9-15-12-23-13-17(26-15)16-8-18-14(10-24-16)11-25-29(18)20-3-1-2-19(27-20)28-6-4-22-5-7-28/h1-3,8,10-13,22H,4-7H2.
What are the key properties of 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile?
6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile has a molecular weight of 383.42 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]pyrazine-2-carbonitrile is sourced from PubChem (CID 72715617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).