3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane

C9H17Cl2NSi — CID 173270803

IUPAC3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
SMILESCl[SiH](Cl)N1CCCC2CCCCC21
InChIInChI=1S/C9H17Cl2NSi/c10-13(11)12-7-3-5-8-4-1-2-6-9(8)12/h8-9,13H,1-7H2
InChIKeySLGRAIPCJXNSKC-UHFFFAOYSA-N
MW238.23 g/mol
LogP2.84
Rot. Bonds1

About 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane

3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane (PubChem CID 173270803) has the molecular formula C9H17Cl2NSi and a molecular weight of 238.23 g/mol. Its IUPAC name is 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane.

Molecular Properties

Compound Name3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
PubChem CID173270803
Molecular FormulaC9H17Cl2NSi
Molecular Weight238.23 g/mol
Exact Mass237.05
IUPAC Name3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
SMILESCl[SiH](Cl)N1CCCC2CCCCC21
InChIInChI=1S/C9H17Cl2NSi/c10-13(11)12-7-3-5-8-4-1-2-6-9(8)12/h8-9,13H,1-7H2
InChIKeySLGRAIPCJXNSKC-UHFFFAOYSA-N
XLogP2.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.23
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline;3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
CID 173270802
(4aR)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 143862293
CID 147803814
CID 147803814
(4aR,8aR)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 642630
1-(4-chlorobut-2-enyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 77051233
1-ethyl-2,3,3a,4,5,6,7,7a-octahydroindole
CID 524515
3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbaldehyde
CID 64992279
1-tert-butyl-2-cyclohexylpyrrolidine
CID 155770261
(3aR,7aR)-1-methyl-2,3,3a,4,5,6,7,7a-octahydroindole
CID 59880463
1-[(8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]ethanone
CID 68573047
1-(trioxidanylsulfanyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline
CID 58391764
2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)cyclooctan-1-ol
CID 65319710

Frequently Asked Questions

What is the IUPAC name of 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane?
The IUPAC name of 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane (CID 173270803) is 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane.
What is the SMILES notation for 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane?
The canonical SMILES for 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane is Cl[SiH](Cl)N1CCCC2CCCCC21.
What is the InChIKey of 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane?
The InChIKey is SLGRAIPCJXNSKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17Cl2NSi/c10-13(11)12-7-3-5-8-4-1-2-6-9(8)12/h8-9,13H,1-7H2.
What are the key properties of 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane?
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane has a molecular weight of 238.23 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane is sourced from PubChem (CID 173270803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).