6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C26H26N10 — CID 126740233

IUPAC6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCn1cc(CN2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)cn1
InChIInChI=1S/C26H26N10/c1-32-15-19(11-29-32)16-34-5-7-35(8-6-34)25-4-3-20(12-28-25)24-9-21(23-14-30-33(2)17-23)18-36-26(24)22(10-27)13-31-36/h3-4,9,11-15,17-18H,5-8,16H2,1-2H3
InChIKeyICLPGRFNAOQDJX-UHFFFAOYSA-N
MW478.56 g/mol
LogP2.72
Rot. Bonds5

About 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 126740233) has the molecular formula C26H26N10 and a molecular weight of 478.56 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID126740233
Molecular FormulaC26H26N10
Molecular Weight478.56 g/mol
Exact Mass478.23
IUPAC Name6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCn1cc(CN2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)cn1
InChIInChI=1S/C26H26N10/c1-32-15-19(11-29-32)16-34-5-7-35(8-6-34)25-4-3-20(12-28-25)24-9-21(23-14-30-33(2)17-23)18-36-26(24)22(10-27)13-31-36/h3-4,9,11-15,17-18H,5-8,16H2,1-2H3
InChIKeyICLPGRFNAOQDJX-UHFFFAOYSA-N
XLogP2.72
TPSA96.10 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.56
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 126740233) is 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is Cn1cc(CN2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is ICLPGRFNAOQDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N10/c1-32-15-19(11-29-32)16-34-5-7-35(8-6-34)25-4-3-20(12-28-25)24-9-21(23-14-30-33(2)17-23)18-36-26(24)22(10-27)13-31-36/h3-4,9,11-15,17-18H,5-8,16H2,1-2H3.
What are the key properties of 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 478.56 g/mol, XLogP of 2.72, 5 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)-4-[6-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 126740233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).