N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine

C14H21NSSi — CID 140768167

IUPACN-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine
SMILESC[Si](C)(C)SC1CCC/C1=N\c1ccccc1
InChIInChI=1S/C14H21NSSi/c1-17(2,3)16-14-11-7-10-13(14)15-12-8-5-4-6-9-12/h4-6,8-9,14H,7,10-11H2,1-3H3/b15-13+
InChIKeyAPRAMFHNFCLBIS-FYWRMAATSA-N
MW263.48 g/mol
LogP4.88
Rot. Bonds3

About N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine

N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine (PubChem CID 140768167) has the molecular formula C14H21NSSi and a molecular weight of 263.48 g/mol. Its IUPAC name is N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine.

Molecular Properties

Compound NameN-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine
PubChem CID140768167
Molecular FormulaC14H21NSSi
Molecular Weight263.48 g/mol
Exact Mass263.12
IUPAC NameN-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine
SMILESC[Si](C)(C)SC1CCC/C1=N\c1ccccc1
InChIInChI=1S/C14H21NSSi/c1-17(2,3)16-14-11-7-10-13(14)15-12-8-5-4-6-9-12/h4-6,8-9,14H,7,10-11H2,1-3H3/b15-13+
InChIKeyAPRAMFHNFCLBIS-FYWRMAATSA-N
XLogP4.88
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.48
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-phenyl-4-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768262
N-cyclopentyl-2-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768111
N-cyclohexyl-2-trimethylsilylsulfanylcycloheptan-1-imine
CID 140768335
N-hexyl-2-trimethylsilylsulfanylcyclopentan-1-imine
CID 140768358
N-benzyl-3-trimethylsilylsulfanylcyclohexan-1-imine
CID 140768318
(4aR,8aR)-N-phenyl-2,3,4a,5,6,7,8,8a-octahydro-1H-quinolin-4-imine
CID 12614919
N-phenylbicyclo[4.1.0]hept-1(6)-en-7-imine
CID 101088873
4-phenyliminocyclohexan-1-ol
CID 19962596
(NE)-N-[(2R)-2-phenylsulfanylcycloheptylidene]hydroxylamine
CID 177450432
2-methyl-N-[4-[[3-[(2-methylcyclohexylidene)amino]phenyl]methyl]phenyl]cyclohexan-1-imine
CID 141153276
1-[(4-chlorophenyl)methyl]-N-phenyl-1-azoniabicyclo[2.2.2]octan-3-imine
CID 4230519
[(Z)-(2-phenylsulfanylcyclopentylidene)methyl]sulfanylbenzene
CID 102010830

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine?
The IUPAC name of N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine (CID 140768167) is N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine.
What is the SMILES notation for N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine?
The canonical SMILES for N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine is C[Si](C)(C)SC1CCC/C1=N\c1ccccc1.
What is the InChIKey of N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine?
The InChIKey is APRAMFHNFCLBIS-FYWRMAATSA-N. The full InChI is InChI=1S/C14H21NSSi/c1-17(2,3)16-14-11-7-10-13(14)15-12-8-5-4-6-9-12/h4-6,8-9,14H,7,10-11H2,1-3H3/b15-13+.
What are the key properties of N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine?
N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine has a molecular weight of 263.48 g/mol, XLogP of 4.88, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-trimethylsilylsulfanylcyclopentan-1-imine is sourced from PubChem (CID 140768167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).