6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole

C24H23N9 — CID 118930242

IUPAC6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole
SMILESCn1cc(-c2ccc3cnn(-c4ccnc(N5CCN(c6ccncn6)CC5)c4)c3c2)cn1
InChIInChI=1S/C24H23N9/c1-30-16-20(15-28-30)18-2-3-19-14-29-33(22(19)12-18)21-4-7-26-24(13-21)32-10-8-31(9-11-32)23-5-6-25-17-27-23/h2-7,12-17H,8-11H2,1H3
InChIKeyFINLWIYUTZEPNG-UHFFFAOYSA-N
MW437.51 g/mol
LogP2.94
Rot. Bonds4

About 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole

6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole (PubChem CID 118930242) has the molecular formula C24H23N9 and a molecular weight of 437.51 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole
PubChem CID118930242
Molecular FormulaC24H23N9
Molecular Weight437.51 g/mol
Exact Mass437.21
IUPAC Name6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole
SMILESCn1cc(-c2ccc3cnn(-c4ccnc(N5CCN(c6ccncn6)CC5)c4)c3c2)cn1
InChIInChI=1S/C24H23N9/c1-30-16-20(15-28-30)18-2-3-19-14-29-33(22(19)12-18)21-4-7-26-24(13-21)32-10-8-31(9-11-32)23-5-6-25-17-27-23/h2-7,12-17H,8-11H2,1H3
InChIKeyFINLWIYUTZEPNG-UHFFFAOYSA-N
XLogP2.94
TPSA80.79 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.51
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Related Compounds

1-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]-6-(1-methylpyrazol-4-yl)indazole
CID 118930220
(Z)-3-methylimino-2-[1-[2-(4-methylpiperazin-1-yl)-4-pyridinyl]indazol-6-yl]prop-1-en-1-amine
CID 156661933
6-methyl-1-pyrimidin-4-ylindazole
CID 123216048
6-butan-2-yloxy-1-(2-pyrrolidin-1-yl-4-pyridinyl)indazole
CID 145028092
1-methyl-6-(1-methylpyrazol-4-yl)-3-pyrimidin-4-ylindole
CID 175873323
7-(1-methylpyrazol-4-yl)isoquinoline
CID 134091205
formonitrile;1-[2-(4-methylsulfonylpiperazin-1-yl)-4-pyridinyl]-6-spiro[2.2]pentan-2-ylindazole
CID 142556902
1-[2-(4-methylsulfonylpiperazin-1-yl)-4-pyridinyl]-6-[(2R)-spiro[2.2]pentan-2-yl]indazole
CID 174046981
2-(1-pyrimidin-4-ylindazol-6-yl)pyridine-4-carboxamide
CID 175755966
1-(4-ethenyl-2-pyridinyl)-4-methylpiperazine;N-methyl-6-(1-methylpyrazol-4-yl)isoquinolin-3-amine
CID 145392446
4-[4-[6-[(Z)-1-amino-3-methyliminoprop-1-en-2-yl]indazol-1-yl]-2-pyridinyl]-1-methylpiperazin-2-one
CID 156661924
4-(1-methylpyrazol-4-yl)pyrimidine
CID 3477787

Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole?
The IUPAC name of 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole (CID 118930242) is 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole is Cn1cc(-c2ccc3cnn(-c4ccnc(N5CCN(c6ccncn6)CC5)c4)c3c2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole?
The InChIKey is FINLWIYUTZEPNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N9/c1-30-16-20(15-28-30)18-2-3-19-14-29-33(22(19)12-18)21-4-7-26-24(13-21)32-10-8-31(9-11-32)23-5-6-25-17-27-23/h2-7,12-17H,8-11H2,1H3.
What are the key properties of 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole?
6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole has a molecular weight of 437.51 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)-1-[2-(4-pyrimidin-4-ylpiperazin-1-yl)-4-pyridinyl]indazole is sourced from PubChem (CID 118930242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).