1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole

C13H22Si — CID 91392006

IUPAC1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole
SMILESCC1C2=C(CCCC=C2)[Si](C)(C)C1C
InChIInChI=1S/C13H22Si/c1-10-11(2)14(3,4)13-9-7-5-6-8-12(10)13/h6,8,10-11H,5,7,9H2,1-4H3
InChIKeyQFXUYRRCPMKIDT-UHFFFAOYSA-N
MW206.40 g/mol
LogP4.31
Rot. Bonds

About 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole

1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole (PubChem CID 91392006) has the molecular formula C13H22Si and a molecular weight of 206.40 g/mol. Its IUPAC name is 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole.

Molecular Properties

Compound Name1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole
PubChem CID91392006
Molecular FormulaC13H22Si
Molecular Weight206.40 g/mol
Exact Mass206.15
IUPAC Name1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole
SMILESCC1C2=C(CCCC=C2)[Si](C)(C)C1C
InChIInChI=1S/C13H22Si/c1-10-11(2)14(3,4)13-9-7-5-6-8-12(10)13/h6,8,10-11H,5,7,9H2,1-4H3
InChIKeyQFXUYRRCPMKIDT-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.40
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole 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

7,8-Bis(trimethylsilyl)bicyclo[4.2.1]nona-2,4,7-triene
CID 564252
[(E)-2-(cyclopenten-1-yl)ethenyl]-trimethylsilane
CID 14175462
(2-Ethylcyclopenta-2,4-dien-1-yl)(trimethyl)silane
CID 4441236
Chloro-dimethyl-(3-propan-2-ylcyclopenta-2,4-dien-1-yl)silane
CID 85955993
Trimethyl-(5-propan-2-ylcyclopenta-1,3-dien-1-yl)silane
CID 12547573
(5-Butylcyclopenta-1,3-dien-1-yl)-trimethylsilane
CID 15878340
(Trimethylsilyl)isopropenylcyclopentadiene
CID 129813269
CID 134856656
CID 134856656
[(1R,6S)-7-bicyclo[4.2.1]nona-2,4,7-trienyl]-trimethylsilane
CID 134860399
tert-butyl-[(1S)-1,3-dimethyl-1,8a-dihydroazulen-2-yl]-dimethylsilane
CID 134887101
Bicyclo[4.2.1]nona-2,4,7-triene, 7-(trimethylsilylmethyl)-
CID 553403
Dimethyl-prop-2-enyl-(2,3,4,5-tetramethylcyclopenta-2,4-dien-1-yl)silane
CID 11172063

Frequently Asked Questions

What is the IUPAC name of 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole?
The IUPAC name of 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole (CID 91392006) is 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole.
What is the SMILES notation for 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole?
The canonical SMILES for 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole is CC1C2=C(CCCC=C2)[Si](C)(C)C1C.
What is the InChIKey of 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole?
The InChIKey is QFXUYRRCPMKIDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22Si/c1-10-11(2)14(3,4)13-9-7-5-6-8-12(10)13/h6,8,10-11H,5,7,9H2,1-4H3.
What are the key properties of 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole?
1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole has a molecular weight of 206.40 g/mol, XLogP of 4.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3-tetramethyl-3,6,7,8-tetrahydro-2H-cyclohepta[b]silole is sourced from PubChem (CID 91392006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).