1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one

C9H13NO2 — CID 10773400

IUPAC1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one
SMILESO=C1CCN2CCCCC2=C1O
InChIInChI=1S/C9H13NO2/c11-8-4-6-10-5-2-1-3-7(10)9(8)12/h12H,1-6H2
InChIKeyBXZVDWFZNRSYPM-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.21
Rot. Bonds

About 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one

1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one (PubChem CID 10773400) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one.

Molecular Properties

Compound Name1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one
PubChem CID10773400
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one
SMILESO=C1CCN2CCCCC2=C1O
InChIInChI=1S/C9H13NO2/c11-8-4-6-10-5-2-1-3-7(10)9(8)12/h12H,1-6H2
InChIKeyBXZVDWFZNRSYPM-UHFFFAOYSA-N
XLogP1.21
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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3,4,6,7,8,9-hexahydro-2H-quinolizin-1-yl(phenyl)methanone
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1,7-diazabicyclo[5.2.1]decan-10-one
CID 90224464
6,7,8,9-tetrahydro-4H-quinolizine-1-carboxamide
CID 91528609
1,2,3,4,6,7-hexahydroindolo[2,3-a]quinolizine
CID 18963250
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CID 160955139
1-acetylazonan-2-one
CID 19035113
9-(4-methylphenyl)sulfonyl-2,3,4,6,7,8-hexahydro-1H-quinolizine
CID 11150480
1-(2-oxopiperidine-1-carbonyl)piperidin-2-one
CID 18425054
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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one?
The IUPAC name of 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one (CID 10773400) is 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one.
What is the SMILES notation for 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one?
The canonical SMILES for 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one is O=C1CCN2CCCCC2=C1O.
What is the InChIKey of 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one?
The InChIKey is BXZVDWFZNRSYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c11-8-4-6-10-5-2-1-3-7(10)9(8)12/h12H,1-6H2.
What are the key properties of 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one?
1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one has a molecular weight of 167.21 g/mol, XLogP of 1.21, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3,4,6,7,8,9-hexahydroquinolizin-2-one is sourced from PubChem (CID 10773400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).