trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane

C19H22F3NSi — CID 11725385

IUPACtrimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane
SMILESC[Si](C)(C)CN1Cc2ccccc2C1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H22F3NSi/c1-24(2,3)13-23-12-15-6-4-5-7-17(15)18(23)14-8-10-16(11-9-14)19(20,21)22/h4-11,18H,12-13H2,1-3H3
InChIKeyIZXVTDHVNIVQKF-UHFFFAOYSA-N
MW349.47 g/mol
LogP5.49
Rot. Bonds3

About trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane

trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane (PubChem CID 11725385) has the molecular formula C19H22F3NSi and a molecular weight of 349.47 g/mol. Its IUPAC name is trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane.

Molecular Properties

Compound Nametrimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane
PubChem CID11725385
Molecular FormulaC19H22F3NSi
Molecular Weight349.47 g/mol
Exact Mass349.15
IUPAC Nametrimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane
SMILESC[Si](C)(C)CN1Cc2ccccc2C1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H22F3NSi/c1-24(2,3)13-23-12-15-6-4-5-7-17(15)18(23)14-8-10-16(11-9-14)19(20,21)22/h4-11,18H,12-13H2,1-3H3
InChIKeyIZXVTDHVNIVQKF-UHFFFAOYSA-N
XLogP5.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.47
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane?
The IUPAC name of trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane (CID 11725385) is trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane.
What is the SMILES notation for trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane?
The canonical SMILES for trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane is C[Si](C)(C)CN1Cc2ccccc2C1c1ccc(C(F)(F)F)cc1.
What is the InChIKey of trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane?
The InChIKey is IZXVTDHVNIVQKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F3NSi/c1-24(2,3)13-23-12-15-6-4-5-7-17(15)18(23)14-8-10-16(11-9-14)19(20,21)22/h4-11,18H,12-13H2,1-3H3.
What are the key properties of trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane?
trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane has a molecular weight of 349.47 g/mol, XLogP of 5.49, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[1-[4-(trifluoromethyl)phenyl]-1,3-dihydroisoindol-2-yl]methyl]silane is sourced from PubChem (CID 11725385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).