(2-trimethylsilylsulfanylcycloheptylidene)methanamine

C11H23NSSi — CID 140768355

IUPAC(2-trimethylsilylsulfanylcycloheptylidene)methanamine
SMILESC[Si](C)(C)SC1CCCCCC1=CN
InChIInChI=1S/C11H23NSSi/c1-14(2,3)13-11-8-6-4-5-7-10(11)9-12/h9,11H,4-8,12H2,1-3H3
InChIKeyLKNQILCYPXJXAC-UHFFFAOYSA-N
MW229.46 g/mol
LogP3.73
Rot. Bonds2

About (2-trimethylsilylsulfanylcycloheptylidene)methanamine

(2-trimethylsilylsulfanylcycloheptylidene)methanamine (PubChem CID 140768355) has the molecular formula C11H23NSSi and a molecular weight of 229.46 g/mol. Its IUPAC name is (2-trimethylsilylsulfanylcycloheptylidene)methanamine.

Molecular Properties

Compound Name(2-trimethylsilylsulfanylcycloheptylidene)methanamine
PubChem CID140768355
Molecular FormulaC11H23NSSi
Molecular Weight229.46 g/mol
Exact Mass229.13
IUPAC Name(2-trimethylsilylsulfanylcycloheptylidene)methanamine
SMILESC[Si](C)(C)SC1CCCCCC1=CN
InChIInChI=1S/C11H23NSSi/c1-14(2,3)13-11-8-6-4-5-7-10(11)9-12/h9,11H,4-8,12H2,1-3H3
InChIKeyLKNQILCYPXJXAC-UHFFFAOYSA-N
XLogP3.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.46
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexyl-2-trimethylsilylsulfanylcycloheptan-1-imine
CID 140768335
N-cyclopentyl-2-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768111
N-cycloheptyl-4-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768345
N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine
CID 140768167
(15S)-15-methyl-oxacyclopentadecan-2-one
CID 86278289
(16R)-16-methyl-oxacyclohexadecan-2-one
CID 10978020
(14R)-14-methyl-oxacyclotetradecan-2-one
CID 11009676
N-hexyl-2-trimethylsilylsulfanylcyclopentan-1-imine
CID 140768358
(1E,2S)-1-ethylidene-2-methylcyclohexane
CID 148695286
1-methyl-2-(2-methylpropylidene)cycloheptane
CID 134902820
9,10-dimethyloxecan-2-one
CID 102227238
11,25,39-trimethyl-1,15,29-trioxacyclodotetracontane-2,16,30-trione
CID 18738133

Frequently Asked Questions

What is the IUPAC name of (2-trimethylsilylsulfanylcycloheptylidene)methanamine?
The IUPAC name of (2-trimethylsilylsulfanylcycloheptylidene)methanamine (CID 140768355) is (2-trimethylsilylsulfanylcycloheptylidene)methanamine.
What is the SMILES notation for (2-trimethylsilylsulfanylcycloheptylidene)methanamine?
The canonical SMILES for (2-trimethylsilylsulfanylcycloheptylidene)methanamine is C[Si](C)(C)SC1CCCCCC1=CN.
What is the InChIKey of (2-trimethylsilylsulfanylcycloheptylidene)methanamine?
The InChIKey is LKNQILCYPXJXAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NSSi/c1-14(2,3)13-11-8-6-4-5-7-10(11)9-12/h9,11H,4-8,12H2,1-3H3.
What are the key properties of (2-trimethylsilylsulfanylcycloheptylidene)methanamine?
(2-trimethylsilylsulfanylcycloheptylidene)methanamine has a molecular weight of 229.46 g/mol, XLogP of 3.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-trimethylsilylsulfanylcycloheptylidene)methanamine is sourced from PubChem (CID 140768355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).