4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide

C19H26N4O4 — CID 122256655

IUPAC4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
SMILESCC(=O)N1CCC(C(=O)N2CCCC(Oc3ccnc(C(N)=O)c3)C2)CC1
InChIInChI=1S/C19H26N4O4/c1-13(24)22-9-5-14(6-10-22)19(26)23-8-2-3-16(12-23)27-15-4-7-21-17(11-15)18(20)25/h4,7,11,14,16H,2-3,5-6,8-10,12H2,1H3,(H2,20,25)
InChIKeyFPISWJFYEQTJQR-UHFFFAOYSA-N
MW374.44 g/mol
LogP0.81
Rot. Bonds4

About 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide

4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide (PubChem CID 122256655) has the molecular formula C19H26N4O4 and a molecular weight of 374.44 g/mol. Its IUPAC name is 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide.

Molecular Properties

Compound Name4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
PubChem CID122256655
Molecular FormulaC19H26N4O4
Molecular Weight374.44 g/mol
Exact Mass374.20
IUPAC Name4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide
SMILESCC(=O)N1CCC(C(=O)N2CCCC(Oc3ccnc(C(N)=O)c3)C2)CC1
InChIInChI=1S/C19H26N4O4/c1-13(24)22-9-5-14(6-10-22)19(26)23-8-2-3-16(12-23)27-15-4-7-21-17(11-15)18(20)25/h4,7,11,14,16H,2-3,5-6,8-10,12H2,1H3,(H2,20,25)
InChIKeyFPISWJFYEQTJQR-UHFFFAOYSA-N
XLogP0.81
TPSA105.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The IUPAC name of 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide (CID 122256655) is 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide.
What is the SMILES notation for 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The canonical SMILES for 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide is CC(=O)N1CCC(C(=O)N2CCCC(Oc3ccnc(C(N)=O)c3)C2)CC1.
What is the InChIKey of 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide?
The InChIKey is FPISWJFYEQTJQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O4/c1-13(24)22-9-5-14(6-10-22)19(26)23-8-2-3-16(12-23)27-15-4-7-21-17(11-15)18(20)25/h4,7,11,14,16H,2-3,5-6,8-10,12H2,1H3,(H2,20,25).
What are the key properties of 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide?
4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 0.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(1-acetylpiperidine-4-carbonyl)piperidin-3-yl]oxypyridine-2-carboxamide is sourced from PubChem (CID 122256655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).