3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole

C19H19N7S — CID 72715138

IUPAC3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole
SMILESCc1cc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)sn1
InChIInChI=1S/C19H19N7S/c1-13-9-17(27-24-13)15-10-16-14(11-21-15)12-22-26(16)19-4-2-3-18(23-19)25-7-5-20-6-8-25/h2-4,9-12,20H,5-8H2,1H3
InChIKeyHIWTYESDVJEVCS-UHFFFAOYSA-N
MW377.48 g/mol
LogP2.66
Rot. Bonds3

About 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole

3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole (PubChem CID 72715138) has the molecular formula C19H19N7S and a molecular weight of 377.48 g/mol. Its IUPAC name is 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole.

Molecular Properties

Compound Name3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole
PubChem CID72715138
Molecular FormulaC19H19N7S
Molecular Weight377.48 g/mol
Exact Mass377.14
IUPAC Name3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole
SMILESCc1cc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)sn1
InChIInChI=1S/C19H19N7S/c1-13-9-17(27-24-13)15-10-16-14(11-21-15)12-22-26(16)19-4-2-3-18(23-19)25-7-5-20-6-8-25/h2-4,9-12,20H,5-8H2,1H3
InChIKeyHIWTYESDVJEVCS-UHFFFAOYSA-N
XLogP2.66
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.48
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole?
The IUPAC name of 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole (CID 72715138) is 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole.
What is the SMILES notation for 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole?
The canonical SMILES for 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole is Cc1cc(-c2cc3c(cn2)cnn3-c2cccc(N3CCNCC3)n2)sn1.
What is the InChIKey of 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole?
The InChIKey is HIWTYESDVJEVCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N7S/c1-13-9-17(27-24-13)15-10-16-14(11-21-15)12-22-26(16)19-4-2-3-18(23-19)25-7-5-20-6-8-25/h2-4,9-12,20H,5-8H2,1H3.
What are the key properties of 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole?
3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole has a molecular weight of 377.48 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-[1-(6-piperazin-1-yl-2-pyridinyl)pyrazolo[4,3-c]pyridin-6-yl]-1,2-thiazole is sourced from PubChem (CID 72715138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).