N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide

C23H22N6O — CID 89450862

IUPACN-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCCC2)nc1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C23H22N6O/c30-23(26-18-7-9-21(25-15-18)29-11-2-1-3-12-29)22-19-13-16(6-8-20(19)27-28-22)17-5-4-10-24-14-17/h4-10,13-15H,1-3,11-12H2,(H,26,30)(H,27,28)
InChIKeyUEXLXTFGLOKPDC-UHFFFAOYSA-N
MW398.47 g/mol
LogP4.26
Rot. Bonds4

About N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide

N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide (PubChem CID 89450862) has the molecular formula C23H22N6O and a molecular weight of 398.47 g/mol. Its IUPAC name is N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
PubChem CID89450862
Molecular FormulaC23H22N6O
Molecular Weight398.47 g/mol
Exact Mass398.19
IUPAC NameN-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCCC2)nc1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C23H22N6O/c30-23(26-18-7-9-21(25-15-18)29-11-2-1-3-12-29)22-19-13-16(6-8-20(19)27-28-22)17-5-4-10-24-14-17/h4-10,13-15H,1-3,11-12H2,(H,26,30)(H,27,28)
InChIKeyUEXLXTFGLOKPDC-UHFFFAOYSA-N
XLogP4.26
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.47
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The IUPAC name of N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide (CID 89450862) is N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The canonical SMILES for N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide is O=C(Nc1ccc(N2CCCCC2)nc1)c1n[nH]c2ccc(-c3cccnc3)cc12.
What is the InChIKey of N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The InChIKey is UEXLXTFGLOKPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N6O/c30-23(26-18-7-9-21(25-15-18)29-11-2-1-3-12-29)22-19-13-16(6-8-20(19)27-28-22)17-5-4-10-24-14-17/h4-10,13-15H,1-3,11-12H2,(H,26,30)(H,27,28).
What are the key properties of N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide has a molecular weight of 398.47 g/mol, XLogP of 4.26, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide is sourced from PubChem (CID 89450862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).