4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide

C17H20N4O2 — CID 75509918

IUPAC4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide
SMILESCc1cccc(N2CCC(Oc3ccnc(C(N)=O)c3)CC2)n1
InChIInChI=1S/C17H20N4O2/c1-12-3-2-4-16(20-12)21-9-6-13(7-10-21)23-14-5-8-19-15(11-14)17(18)22/h2-5,8,11,13H,6-7,9-10H2,1H3,(H2,18,22)
InChIKeyRHNMIIBOJBMIBS-UHFFFAOYSA-N
MW312.37 g/mol
LogP1.93
Rot. Bonds4

About 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide

4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide (PubChem CID 75509918) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide
PubChem CID75509918
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide
SMILESCc1cccc(N2CCC(Oc3ccnc(C(N)=O)c3)CC2)n1
InChIInChI=1S/C17H20N4O2/c1-12-3-2-4-16(20-12)21-9-6-13(7-10-21)23-14-5-8-19-15(11-14)17(18)22/h2-5,8,11,13H,6-7,9-10H2,1H3,(H2,18,22)
InChIKeyRHNMIIBOJBMIBS-UHFFFAOYSA-N
XLogP1.93
TPSA81.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide (CID 75509918) is 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide is Cc1cccc(N2CCC(Oc3ccnc(C(N)=O)c3)CC2)n1.
What is the InChIKey of 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide?
The InChIKey is RHNMIIBOJBMIBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-12-3-2-4-16(20-12)21-9-6-13(7-10-21)23-14-5-8-19-15(11-14)17(18)22/h2-5,8,11,13H,6-7,9-10H2,1H3,(H2,18,22).
What are the key properties of 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide?
4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 75509918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).