3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol

C7H13NO2 — CID 175915709

IUPAC3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol
SMILESOCN1C2CCC1COC2
InChIInChI=1S/C7H13NO2/c9-5-8-6-1-2-7(8)4-10-3-6/h6-7,9H,1-5H2
InChIKeyXIMNPSBOELKHKZ-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.20
Rot. Bonds1

About 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol

3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol (PubChem CID 175915709) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol.

Molecular Properties

Compound Name3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol
PubChem CID175915709
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol
SMILESOCN1C2CCC1COC2
InChIInChI=1S/C7H13NO2/c9-5-8-6-1-2-7(8)4-10-3-6/h6-7,9H,1-5H2
InChIKeyXIMNPSBOELKHKZ-UHFFFAOYSA-N
XLogP-0.20
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,7-Difluoro-8-methyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 137453683
(2S)-2-fluoro-3-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)propan-1-ol
CID 170083577
6,6-Difluoro-8-methanidyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 145770869
6,7-Difluoro-8-methanidyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 145770875
1-Fluoro-3-{3-oxa-8-azabicyclo[3.2.1]octan-8-yl}propan-2-ol
CID 165590936
3-Oxa-8-azabicyclo[3.2.1]octane-8-carbaldehyde
CID 21925204
3-(3-Oxa-8-azabicyclo[3.2.1]octan-8-yl)propan-1-ol
CID 21925258
8-Propan-2-yl-3-oxa-8-azabicyclo[3.2.1]octane
CID 58110399
8-Methyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 59091369
8-Propyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 68104169
8-Ethyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 68238255
8-Sulfanyl-3-oxa-8-azabicyclo[3.2.1]octane
CID 89903553

Frequently Asked Questions

What is the IUPAC name of 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol?
The IUPAC name of 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol (CID 175915709) is 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol.
What is the SMILES notation for 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol?
The canonical SMILES for 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol is OCN1C2CCC1COC2.
What is the InChIKey of 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol?
The InChIKey is XIMNPSBOELKHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c9-5-8-6-1-2-7(8)4-10-3-6/h6-7,9H,1-5H2.
What are the key properties of 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol?
3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol has a molecular weight of 143.19 g/mol, XLogP of -0.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oxa-8-azabicyclo[3.2.1]octan-8-ylmethanol is sourced from PubChem (CID 175915709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).