2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone

Name: 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₅H₁₉NO₃ — CID 105119165

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone

SMILESCc1ccc(C(=O)C2CCOC3(CCOC3)C2)cn1

InChIInChI=1S/C15H19NO3/c1-11-2-3-13(9-16-11)14(17)12-4-6-19-15(8-12)5-7-18-10-15/h2-3,9,12H,4-8,10H2,1H3

InChIKeyFDDACBPWLRPHNW-UHFFFAOYSA-N

MW261.32 g/mol

LogP2.16

Rot. Bonds2

About 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone

2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone (PubChem CID 105119165) has the molecular formula C₁₅H₁₉NO₃ and a molecular weight of 261.32 g/mol. Its IUPAC name is 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name	2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone
PubChem CID	105119165
Molecular Formula	C₁₅H₁₉NO₃
Molecular Weight	261.32 g/mol
Exact Mass	261.14
IUPAC Name	2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone
SMILES	Cc1ccc(C(=O)C2CCOC3(CCOC3)C2)cn1
InChI	InChI=1S/C15H19NO3/c1-11-2-3-13(9-16-11)14(17)12-4-6-19-15(8-12)5-7-18-10-15/h2-3,9,12H,4-8,10H2,1H3
InChIKey	FDDACBPWLRPHNW-UHFFFAOYSA-N
XLogP	2.16
TPSA	48.42 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	2
Heavy Atoms	19
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	261.32
LogP ≤ 5	2.16
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone?

The IUPAC name of 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone (CID 105119165) is 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone.

What is the SMILES notation for 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone?

The canonical SMILES for 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone is Cc1ccc(C(=O)C2CCOC3(CCOC3)C2)cn1.

What is the InChIKey of 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone?

The InChIKey is FDDACBPWLRPHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-11-2-3-13(9-16-11)14(17)12-4-6-19-15(8-12)5-7-18-10-15/h2-3,9,12H,4-8,10H2,1H3.

What are the key properties of 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone?

2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone has a molecular weight of 261.32 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 2,6-dioxaspiro[4.5]decan-9-yl-(6-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 105119165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 105119165 — identifiers, structure, computed properties (public domain)

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