6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol

C8H16N2O — CID 143932216

IUPAC6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
SMILESNC1CC(O)C2CCCN2C1
InChIInChI=1S/C8H16N2O/c9-6-4-8(11)7-2-1-3-10(7)5-6/h6-8,11H,1-5,9H2
InChIKeyUPFWKWFNUBDPSY-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.46
Rot. Bonds

About 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol

6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol (PubChem CID 143932216) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol.

Molecular Properties

Compound Name6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
PubChem CID143932216
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
SMILESNC1CC(O)C2CCCN2C1
InChIInChI=1S/C8H16N2O/c9-6-4-8(11)7-2-1-3-10(7)5-6/h6-8,11H,1-5,9H2
InChIKeyUPFWKWFNUBDPSY-UHFFFAOYSA-N
XLogP-0.46
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
The IUPAC name of 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol (CID 143932216) is 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol.
What is the SMILES notation for 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
The canonical SMILES for 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol is NC1CC(O)C2CCCN2C1.
What is the InChIKey of 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
The InChIKey is UPFWKWFNUBDPSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c9-6-4-8(11)7-2-1-3-10(7)5-6/h6-8,11H,1-5,9H2.
What are the key properties of 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol has a molecular weight of 156.23 g/mol, XLogP of -0.46, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol is sourced from PubChem (CID 143932216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).