6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol

Name: 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₀H₁₉NO — CID 117050678

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

IUPAC6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol

SMILESCC(C)N1CC2CC1CCC2O

InChIInChI=1S/C10H19NO/c1-7(2)11-6-8-5-9(11)3-4-10(8)12/h7-10,12H,3-6H2,1-2H3

InChIKeyVGBLPOCEMJVLQH-UHFFFAOYSA-N

MW169.27 g/mol

LogP1.24

Rot. Bonds1

About 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol

6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol (PubChem CID 117050678) has the molecular formula C₁₀H₁₉NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol.

Molecular Properties

Compound Name	6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol
PubChem CID	117050678
Molecular Formula	C₁₀H₁₉NO
Molecular Weight	169.27 g/mol
Exact Mass	169.15
IUPAC Name	6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol
SMILES	CC(C)N1CC2CC1CCC2O
InChI	InChI=1S/C10H19NO/c1-7(2)11-6-8-5-9(11)3-4-10(8)12/h7-10,12H,3-6H2,1-2H3
InChIKey	VGBLPOCEMJVLQH-UHFFFAOYSA-N
XLogP	1.24
TPSA	23.47 Å²
H-Bond Donors	1
H-Bond Acceptors	2
Rotatable Bonds	1
Heavy Atoms	12
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	169.27
LogP ≤ 5	1.24
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol?

The IUPAC name of 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol (CID 117050678) is 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol.

What is the SMILES notation for 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol?

The canonical SMILES for 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol is CC(C)N1CC2CC1CCC2O.

What is the InChIKey of 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol?

The InChIKey is VGBLPOCEMJVLQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7(2)11-6-8-5-9(11)3-4-10(8)12/h7-10,12H,3-6H2,1-2H3.

What are the key properties of 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol?

6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol has a molecular weight of 169.27 g/mol, XLogP of 1.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol is sourced from PubChem (CID 117050678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 117050678 — identifiers, structure, computed properties (public domain)

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