8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol

C14H25NO — CID 107010099

IUPAC8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESC=CCCCCCN1C2CCC1CC(O)C2
InChIInChI=1S/C14H25NO/c1-2-3-4-5-6-9-15-12-7-8-13(15)11-14(16)10-12/h2,12-14,16H,1,3-11H2
InChIKeyZWNYNUGBCDITAI-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.72
Rot. Bonds6

About 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol

8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol (PubChem CID 107010099) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol.

Molecular Properties

Compound Name8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol
PubChem CID107010099
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol
SMILESC=CCCCCCN1C2CCC1CC(O)C2
InChIInChI=1S/C14H25NO/c1-2-3-4-5-6-9-15-12-7-8-13(15)11-14(16)10-12/h2,12-14,16H,1,3-11H2
InChIKeyZWNYNUGBCDITAI-UHFFFAOYSA-N
XLogP2.72
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

8-Allyl-3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octane
CID 16193543
3-Hydroxy-8-methyl-8-(prop-2-en-1-yl)-8-azoniabicyclo[3.2.1]octane
CID 5003946
(2S,3S,8aR)-3-prop-2-enyl-1,2,3,5,6,7,8,8a-octahydroindolizin-2-ol
CID 139195361
(5S,6S,8aR)-5-prop-2-enyl-1,2,3,5,6,7,8,8a-octahydroindolizin-6-ol
CID 139195362
4-((3R,5R,8aR)-5-(Pent-4-en-1-yl)octahydroindolizin-3-yl)butan-2-ol
CID 91731710
8-Methyl-3-methylidene-8-azabicyclo[3.2.1]octan-6-ol
CID 58902791
8-(Prop-2-en-1-yl)-8-azabicyclo[3.2.1]octan-3-ol
CID 63768538
8-[(E)-but-2-enyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 63769771
2-(1-But-3-enylpiperidin-2-yl)ethanol
CID 64297267
8-Prop-2-enyl-8-azabicyclo[3.2.1]octan-3-ol;hydrochloride
CID 70504469
1,2-Bis(prop-2-enyl)piperidin-4-ol
CID 156701736
(5R)-8-(2-hydroxybut-3-enyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 163660256

Frequently Asked Questions

What is the IUPAC name of 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol?
The IUPAC name of 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol (CID 107010099) is 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol.
What is the SMILES notation for 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol?
The canonical SMILES for 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol is C=CCCCCCN1C2CCC1CC(O)C2.
What is the InChIKey of 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol?
The InChIKey is ZWNYNUGBCDITAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-2-3-4-5-6-9-15-12-7-8-13(15)11-14(16)10-12/h2,12-14,16H,1,3-11H2.
What are the key properties of 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol?
8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol has a molecular weight of 223.36 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hept-6-enyl-8-azabicyclo[3.2.1]octan-3-ol is sourced from PubChem (CID 107010099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).