(8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol

C11H22N2O — CID 143932217

IUPAC(8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
SMILESCCN(C)C1C[C@H](O)C2CCCN2C1
InChIInChI=1S/C11H22N2O/c1-3-12(2)9-7-11(14)10-5-4-6-13(10)8-9/h9-11,14H,3-8H2,1-2H3/t9?,10?,11-/m0/s1
InChIKeyUDQYIUYWYGPUAP-ILDUYXDCSA-N
MW198.31 g/mol
LogP0.54
Rot. Bonds2

About (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol

(8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol (PubChem CID 143932217) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol.

Molecular Properties

Compound Name(8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
PubChem CID143932217
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
SMILESCCN(C)C1C[C@H](O)C2CCCN2C1
InChIInChI=1S/C11H22N2O/c1-3-12(2)9-7-11(14)10-5-4-6-13(10)8-9/h9-11,14H,3-8H2,1-2H3/t9?,10?,11-/m0/s1
InChIKeyUDQYIUYWYGPUAP-ILDUYXDCSA-N
XLogP0.54
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6R)-6-pyrrolidin-1-yl-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol
CID 143932220
trans-(1R,2R)-2-[3-(dimethylamino)pyrrolidin-1-yl]cyclohexan-1-ol
CID 102732127
2-[3-(dimethylamino)pyrrolidin-1-yl]cyclododecan-1-ol
CID 63165145
trans-(1S,2S)-2-(3-ethoxypiperidin-1-yl)cyclohexan-1-ol
CID 102732019
6-[3-(dimethylamino)piperidin-1-yl]-2,2-dimethylcyclohexan-1-ol
CID 79847899
(1S,2S,8R)-1-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-2-ol
CID 11457819
2-[3-(diethylamino)pyrrolidin-1-yl]-4-ethylcyclohexan-1-ol
CID 63165668
1-(8-hydroxy-1,2,3,5,6,7,8,8a-octahydroindolizin-6-yl)-3-methylurea
CID 143932229
trans-(1S,2S)-2-[3-(methoxymethyl)piperidin-1-yl]cyclohexan-1-ol
CID 106588237
(6R,7S,8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-6,7,8-triol
CID 11401041
3-[ethyl(methyl)amino]cyclopentan-1-ol
CID 79643360
(3R)-N-ethyl-N-methyl-1-propan-2-ylpiperidin-3-amine
CID 164856684

Frequently Asked Questions

What is the IUPAC name of (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
The IUPAC name of (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol (CID 143932217) is (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol.
What is the SMILES notation for (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
The canonical SMILES for (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol is CCN(C)C1C[C@H](O)C2CCCN2C1.
What is the InChIKey of (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
The InChIKey is UDQYIUYWYGPUAP-ILDUYXDCSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-12(2)9-7-11(14)10-5-4-6-13(10)8-9/h9-11,14H,3-8H2,1-2H3/t9?,10?,11-/m0/s1.
What are the key properties of (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol?
(8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol has a molecular weight of 198.31 g/mol, XLogP of 0.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-6-[ethyl(methyl)amino]-1,2,3,5,6,7,8,8a-octahydroindolizin-8-ol is sourced from PubChem (CID 143932217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).