5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine

C25H24N6 — CID 137115913

IUPAC5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine
SMILESNc1cncc(-c2ccc3[nH]nc(-c4cc5c(N6CCCCC6)cccc5[nH]4)c3c2)c1
InChIInChI=1S/C25H24N6/c26-18-11-17(14-27-15-18)16-7-8-22-20(12-16)25(30-29-22)23-13-19-21(28-23)5-4-6-24(19)31-9-2-1-3-10-31/h4-8,11-15,28H,1-3,9-10,26H2,(H,29,30)
InChIKeyLGPGKNICHUUPJH-UHFFFAOYSA-N
MW408.51 g/mol
LogP5.35
Rot. Bonds3

About 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine

5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine (PubChem CID 137115913) has the molecular formula C25H24N6 and a molecular weight of 408.51 g/mol. Its IUPAC name is 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine.

Molecular Properties

Compound Name5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine
PubChem CID137115913
Molecular FormulaC25H24N6
Molecular Weight408.51 g/mol
Exact Mass408.21
IUPAC Name5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine
SMILESNc1cncc(-c2ccc3[nH]nc(-c4cc5c(N6CCCCC6)cccc5[nH]4)c3c2)c1
InChIInChI=1S/C25H24N6/c26-18-11-17(14-27-15-18)16-7-8-22-20(12-16)25(30-29-22)23-13-19-21(28-23)5-4-6-24(19)31-9-2-1-3-10-31/h4-8,11-15,28H,1-3,9-10,26H2,(H,29,30)
InChIKeyLGPGKNICHUUPJH-UHFFFAOYSA-N
XLogP5.35
TPSA86.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.51
LogP ≤ 55.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-[3-(4-piperidin-1-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137111535
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole
CID 137115804
N,N-dimethyl-2-[[5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]-3-pyridinyl]oxy]ethanamine
CID 137310744
N,N-dimethyl-5-[3-[4-(4-methylpiperazin-1-yl)-1H-indol-2-yl]-1H-indazol-5-yl]pyridin-3-amine
CID 137115280
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyridin-3-yl-1H-pyrazolo[4,3-b]pyridine
CID 137114479
3-(4-piperidin-1-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole
CID 137087962
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-pyrazin-2-yl-1H-pyrazolo[3,4-c]pyridine
CID 137112914
3-(4-piperidin-1-yl-1H-pyrrolo[2,3-b]pyridin-2-yl)-5-pyrimidin-5-yl-1H-indazole
CID 137111591
5-[3-(4-pyridin-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137113766
3-(4-piperidin-1-yl-1H-indol-2-yl)-5-(1H-pyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridine
CID 137113468
N-[5-[3-[4-(4-methylpiperazin-1-yl)-1H-indol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]propanamide
CID 137115371
5-[3-(4-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridin-2-yl)-1H-indazol-5-yl]pyridin-3-amine
CID 137116967

Frequently Asked Questions

What is the IUPAC name of 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
The IUPAC name of 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine (CID 137115913) is 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine.
What is the SMILES notation for 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
The canonical SMILES for 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine is Nc1cncc(-c2ccc3[nH]nc(-c4cc5c(N6CCCCC6)cccc5[nH]4)c3c2)c1.
What is the InChIKey of 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
The InChIKey is LGPGKNICHUUPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6/c26-18-11-17(14-27-15-18)16-7-8-22-20(12-16)25(30-29-22)23-13-19-21(28-23)5-4-6-24(19)31-9-2-1-3-10-31/h4-8,11-15,28H,1-3,9-10,26H2,(H,29,30).
What are the key properties of 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine?
5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine has a molecular weight of 408.51 g/mol, XLogP of 5.35, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(4-piperidin-1-yl-1H-indol-2-yl)-1H-indazol-5-yl]pyridin-3-amine is sourced from PubChem (CID 137115913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).