dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane

C11H22Cl2NSi+ — CID 173270943

IUPACdichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane
SMILESCCC[N+]1([SiH](Cl)Cl)CCC2CCCCC21
InChIInChI=1S/C11H22Cl2NSi/c1-2-8-14(15(12)13)9-7-10-5-3-4-6-11(10)14/h10-11,15H,2-9H2,1H3/q+1
InChIKeyBFZUPJITJAKVIV-UHFFFAOYSA-N
MW267.30 g/mol
LogP3.37
Rot. Bonds3

About dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane

dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane (PubChem CID 173270943) has the molecular formula C11H22Cl2NSi+ and a molecular weight of 267.30 g/mol. Its IUPAC name is dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane.

Molecular Properties

Compound Namedichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane
PubChem CID173270943
Molecular FormulaC11H22Cl2NSi+
Molecular Weight267.30 g/mol
Exact Mass266.09
IUPAC Namedichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane
SMILESCCC[N+]1([SiH](Cl)Cl)CCC2CCCCC21
InChIInChI=1S/C11H22Cl2NSi/c1-2-8-14(15(12)13)9-7-10-5-3-4-6-11(10)14/h10-11,15H,2-9H2,1H3/q+1
InChIKeyBFZUPJITJAKVIV-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane with MolForge

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Related Compounds

1,1-dimethyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ium
CID 20676418
1-butyl-4-cyclohexyl-1-hydroxypiperidin-1-ium;hydrochloride
CID 21119340
(4aR,8aR)-1,1,4,4-tetrabutyl-2,3,4a,5,6,7,8,8a-octahydroquinoxaline-1,4-diium dichloride
CID 131883004
(2S)-2-[(1R,3aS,6aS)-1-oxido-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrol-1-ium-1-yl]propan-1-ol
CID 100965170
(3aS,7aR)-2-decyl-2-hexadecyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium
CID 98573317
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;cyclopentane;hexane;propane
CID 173273683
1,2-dimethyl-1-propylpiperidin-1-ium bromide
CID 66624879
1-cyclopentyl-1-propylpyrrolidin-1-ium-2-one
CID 57278709
1,3-dimethyl-1-propylpiperidin-1-ium;methane
CID 159441399
(3aS,7aS)-2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium
CID 98573301
(3aR,7aS)-2-hexadecyl-2-methyl-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium
CID 98573300
1-propyl-1-azoniabicyclo[2.2.2]octane
CID 14642664

Frequently Asked Questions

What is the IUPAC name of dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane?
The IUPAC name of dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane (CID 173270943) is dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane.
What is the SMILES notation for dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane?
The canonical SMILES for dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane is CCC[N+]1([SiH](Cl)Cl)CCC2CCCCC21.
What is the InChIKey of dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane?
The InChIKey is BFZUPJITJAKVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22Cl2NSi/c1-2-8-14(15(12)13)9-7-10-5-3-4-6-11(10)14/h10-11,15H,2-9H2,1H3/q+1.
What are the key properties of dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane?
dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane has a molecular weight of 267.30 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(1-propyl-2,3,3a,4,5,6,7,7a-octahydroindol-1-ium-1-yl)silane is sourced from PubChem (CID 173270943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).