5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide

C25H30N8O3 — CID 154654675

IUPAC5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide
SMILESO=C(Nc1cn[nH]c1C(=O)Nc1ccc(N2CCCCC2)nc1)c1cncc(OC2CCNCC2)c1
InChIInChI=1S/C25H30N8O3/c34-24(17-12-20(15-27-13-17)36-19-6-8-26-9-7-19)31-21-16-29-32-23(21)25(35)30-18-4-5-22(28-14-18)33-10-2-1-3-11-33/h4-5,12-16,19,26H,1-3,6-11H2,(H,29,32)(H,30,35)(H,31,34)
InChIKeyVKFHPYRECIPMDD-UHFFFAOYSA-N
MW490.57 g/mol
LogP2.83
Rot. Bonds7

About 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide

5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide (PubChem CID 154654675) has the molecular formula C25H30N8O3 and a molecular weight of 490.57 g/mol. Its IUPAC name is 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide
PubChem CID154654675
Molecular FormulaC25H30N8O3
Molecular Weight490.57 g/mol
Exact Mass490.24
IUPAC Name5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide
SMILESO=C(Nc1cn[nH]c1C(=O)Nc1ccc(N2CCCCC2)nc1)c1cncc(OC2CCNCC2)c1
InChIInChI=1S/C25H30N8O3/c34-24(17-12-20(15-27-13-17)36-19-6-8-26-9-7-19)31-21-16-29-32-23(21)25(35)30-18-4-5-22(28-14-18)33-10-2-1-3-11-33/h4-5,12-16,19,26H,1-3,6-11H2,(H,29,32)(H,30,35)(H,31,34)
InChIKeyVKFHPYRECIPMDD-UHFFFAOYSA-N
XLogP2.83
TPSA137.16 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.57
LogP ≤ 52.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide?
The IUPAC name of 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide (CID 154654675) is 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide?
The canonical SMILES for 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide is O=C(Nc1cn[nH]c1C(=O)Nc1ccc(N2CCCCC2)nc1)c1cncc(OC2CCNCC2)c1.
What is the InChIKey of 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide?
The InChIKey is VKFHPYRECIPMDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N8O3/c34-24(17-12-20(15-27-13-17)36-19-6-8-26-9-7-19)31-21-16-29-32-23(21)25(35)30-18-4-5-22(28-14-18)33-10-2-1-3-11-33/h4-5,12-16,19,26H,1-3,6-11H2,(H,29,32)(H,30,35)(H,31,34).
What are the key properties of 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide?
5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide has a molecular weight of 490.57 g/mol, XLogP of 2.83, 7 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-4-yloxy-N-[5-[(6-piperidin-1-yl-3-pyridinyl)carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 154654675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).