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

C18H34Cl2N2Si — CID 173270802

IUPAC1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline;3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
SMILESC1CCC2NCCCC2C1.Cl[SiH](Cl)N1CCCC2CCCCC21
InChIInChI=1S/C9H17Cl2NSi.C9H17N/c10-13(11)12-7-3-5-8-4-1-2-6-9(8)12;1-2-6-9-8(4-1)5-3-7-10-9/h8-9,13H,1-7H2;8-10H,1-7H2
InChIKeyZOZHIHQWTCLVCY-UHFFFAOYSA-N
MW377.48 g/mol
LogP4.76
Rot. Bonds1

About 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

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 (PubChem CID 173270802) has the molecular formula C18H34Cl2N2Si and a molecular weight of 377.48 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline;3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
PubChem CID173270802
Molecular FormulaC18H34Cl2N2Si
Molecular Weight377.48 g/mol
Exact Mass376.19
IUPAC Name1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline;3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl(dichloro)silane
SMILESC1CCC2NCCCC2C1.Cl[SiH](Cl)N1CCCC2CCCCC21
InChIInChI=1S/C9H17Cl2NSi.C9H17N/c10-13(11)12-7-3-5-8-4-1-2-6-9(8)12;1-2-6-9-8(4-1)5-3-7-10-9/h8-9,13H,1-7H2;8-10H,1-7H2
InChIKeyZOZHIHQWTCLVCY-UHFFFAOYSA-N
XLogP4.76
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.48
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is C1CCC2NCCCC2C1.Cl[SiH](Cl)N1CCCC2CCCCC21.
What is the InChIKey of 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?
The InChIKey is ZOZHIHQWTCLVCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17Cl2NSi.C9H17N/c10-13(11)12-7-3-5-8-4-1-2-6-9(8)12;1-2-6-9-8(4-1)5-3-7-10-9/h8-9,13H,1-7H2;8-10H,1-7H2.
What are the key properties of 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?
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 has a molecular weight of 377.48 g/mol, XLogP of 4.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 173270802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).