[(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol

C10H19NO — CID 6432466

IUPAC[(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol
SMILESOC[C@@H]1CCCN2CCCCC12
InChIInChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10?/m0/s1
InChIKeyHDVAWXXJVMJBAR-RGURZIINSA-N
MW169.27 g/mol
LogP1.24
Rot. Bonds1

About [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol

[(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol (PubChem CID 6432466) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol.

Molecular Properties

Compound Name[(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol
PubChem CID6432466
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name[(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol
SMILESOC[C@@H]1CCCN2CCCCC12
InChIInChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10?/m0/s1
InChIKeyHDVAWXXJVMJBAR-RGURZIINSA-N
XLogP1.24
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol?
The IUPAC name of [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol (CID 6432466) is [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol.
What is the SMILES notation for [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol?
The canonical SMILES for [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol is OC[C@@H]1CCCN2CCCCC12.
What is the InChIKey of [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol?
The InChIKey is HDVAWXXJVMJBAR-RGURZIINSA-N. The full InChI is InChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10?/m0/s1.
What are the key properties of [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol?
[(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol 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 [(1R)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methanol is sourced from PubChem (CID 6432466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).