(4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane

C14H22FNSi — CID 19007253

IUPAC(4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane
SMILESC[Si](C)(Cc1ccc(F)cc1)CN1CCCC1
InChIInChI=1S/C14H22FNSi/c1-17(2,12-16-9-3-4-10-16)11-13-5-7-14(15)8-6-13/h5-8H,3-4,9-12H2,1-2H3
InChIKeyXUPWPTIKTJQESA-UHFFFAOYSA-N
MW251.42 g/mol
LogP3.25
Rot. Bonds4

About (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane

(4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane (PubChem CID 19007253) has the molecular formula C14H22FNSi and a molecular weight of 251.42 g/mol. Its IUPAC name is (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane.

Molecular Properties

Compound Name(4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane
PubChem CID19007253
Molecular FormulaC14H22FNSi
Molecular Weight251.42 g/mol
Exact Mass251.15
IUPAC Name(4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane
SMILESC[Si](C)(Cc1ccc(F)cc1)CN1CCCC1
InChIInChI=1S/C14H22FNSi/c1-17(2,12-16-9-3-4-10-16)11-13-5-7-14(15)8-6-13/h5-8H,3-4,9-12H2,1-2H3
InChIKeyXUPWPTIKTJQESA-UHFFFAOYSA-N
XLogP3.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.42
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

benzyl-dimethyl-(pyrrolidin-1-ylmethyl)silane
CID 19007226
1-[(4-fluorophenyl)methyl]pyrrolidine
CID 10631195
1,4,7,10-tetrakis[(4-fluorophenyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102293981
3-ethyl-5-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole
CID 51075932
(4-fluorophenyl)-[4-(pyrrolidin-1-ylmethyl)phenyl]methanone
CID 24724346
5-[[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]methyl]-3-propyl-1,2,4-oxadiazole
CID 29001704
(3R)-1-[(4-fluorophenyl)methyl]-3-methylpiperidine
CID 51531587
4-[[4-(4-fluorophenyl)phenyl]methyl]morpholine
CID 11161574
1-[(4-ethylphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine
CID 881940
1-[(4-fluorophenyl)methyl]-4-methyliodanuidyl-1,4-diazepane
CID 168949910
(3R)-1-[(4-fluorophenyl)methyl]-3-(trifluoromethyl)piperidine
CID 51970058
1-[4-[(4-fluorophenyl)methyl]-1,4-diazepan-1-yl]-2-methylpropan-2-ol
CID 110932473

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane?
The IUPAC name of (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane (CID 19007253) is (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane.
What is the SMILES notation for (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane?
The canonical SMILES for (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane is C[Si](C)(Cc1ccc(F)cc1)CN1CCCC1.
What is the InChIKey of (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane?
The InChIKey is XUPWPTIKTJQESA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22FNSi/c1-17(2,12-16-9-3-4-10-16)11-13-5-7-14(15)8-6-13/h5-8H,3-4,9-12H2,1-2H3.
What are the key properties of (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane?
(4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane has a molecular weight of 251.42 g/mol, XLogP of 3.25, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)methyl-dimethyl-(pyrrolidin-1-ylmethyl)silane is sourced from PubChem (CID 19007253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).