6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol

Name: 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₆H₁₁NO₃ — CID 154049521

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

IUPAC6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol

SMILESOCC12CNCC(OC1)O2

InChIInChI=1S/C6H11NO3/c8-3-6-2-7-1-5(10-6)9-4-6/h5,7-8H,1-4H2

InChIKeyYROVXQFBDOYLTE-UHFFFAOYSA-N

MW145.16 g/mol

LogP-1.31

Rot. Bonds1

About 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol

6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol (PubChem CID 154049521) has the molecular formula C₆H₁₁NO₃ and a molecular weight of 145.16 g/mol. Its IUPAC name is 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol.

Molecular Properties

Compound Name	6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol
PubChem CID	154049521
Molecular Formula	C₆H₁₁NO₃
Molecular Weight	145.16 g/mol
Exact Mass	145.07
IUPAC Name	6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol
SMILES	OCC12CNCC(OC1)O2
InChI	InChI=1S/C6H11NO3/c8-3-6-2-7-1-5(10-6)9-4-6/h5,7-8H,1-4H2
InChIKey	YROVXQFBDOYLTE-UHFFFAOYSA-N
XLogP	-1.31
TPSA	50.72 Å²
H-Bond Donors	2
H-Bond Acceptors	4
Rotatable Bonds	1
Heavy Atoms	10
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	145.16
LogP ≤ 5	-1.31
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol?

The IUPAC name of 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol (CID 154049521) is 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol.

What is the SMILES notation for 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol?

The canonical SMILES for 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol is OCC12CNCC(OC1)O2.

What is the InChIKey of 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol?

The InChIKey is YROVXQFBDOYLTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c8-3-6-2-7-1-5(10-6)9-4-6/h5,7-8H,1-4H2.

What are the key properties of 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol?

6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol has a molecular weight of 145.16 g/mol, XLogP of -1.31, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 6,8-dioxa-3-azabicyclo[3.2.1]octan-1-ylmethanol is sourced from PubChem (CID 154049521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 154049521 — identifiers, structure, computed properties (public domain)

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