(2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate

C15H20F5NO3Si — CID 90170629

IUPAC(2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate
SMILESCC[Si](CC)(CCCN(F)C(=O)Oc1cc(F)c(F)c(F)c1F)OC
InChIInChI=1S/C15H20F5NO3Si/c1-4-25(5-2,23-3)8-6-7-21(20)15(22)24-11-9-10(16)12(17)14(19)13(11)18/h9H,4-8H2,1-3H3
InChIKeyRFVVJLZQPSQKHU-UHFFFAOYSA-N
MW385.41 g/mol
LogP4.95
Rot. Bonds8

About (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate

(2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate (PubChem CID 90170629) has the molecular formula C15H20F5NO3Si and a molecular weight of 385.41 g/mol. Its IUPAC name is (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate.

Molecular Properties

Compound Name(2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate
PubChem CID90170629
Molecular FormulaC15H20F5NO3Si
Molecular Weight385.41 g/mol
Exact Mass385.11
IUPAC Name(2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate
SMILESCC[Si](CC)(CCCN(F)C(=O)Oc1cc(F)c(F)c(F)c1F)OC
InChIInChI=1S/C15H20F5NO3Si/c1-4-25(5-2,23-3)8-6-7-21(20)15(22)24-11-9-10(16)12(17)14(19)13(11)18/h9H,4-8H2,1-3H3
InChIKeyRFVVJLZQPSQKHU-UHFFFAOYSA-N
XLogP4.95
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.41
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

Analyze (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate 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

(2,3,4,5-tetrafluorophenyl) N-[4-[dimethoxy(methyl)silyl]butyl]-N-fluorocarbamate
CID 90174768
N-[3-[diethyl(methoxy)silyl]propyl]-N,2,3,4,5-pentafluorobenzamide
CID 90170617
N,2,3,4,5-pentafluoro-N-(3-trimethoxysilylpropyl)benzamide
CID 90170601
(2,3,4,5-tetrafluorophenyl) pentanoate
CID 174399623
(2,3,4,5-tetrafluorophenyl) 2-oxopropanoate
CID 143785419
1-[3-[ethoxy(dimethoxy)silyl]propyl]-1,3-difluoro-3-(2,3,4-trifluorophenyl)urea
CID 90170159
[3-(N,2,3,4,5-pentafluoroanilino)propyl-di(propanoyloxy)silyl] propanoate
CID 90172480
methyl 3-[ethyl-(2,3,4,5-tetrafluorobenzoyl)amino]propanoate
CID 61007496
methyl 2-ethoxy-5-fluoropyridine-4-carboxylate
CID 118989859
diethyl-methoxy-(2,3,4,5-tetrafluorophenyl)silane
CID 90172691
(5-amino-2,3,4-trifluorophenyl) ethyl carbonate
CID 86749657
ethyl 2-fluoro-4,5-dimethoxybenzoate
CID 163198249

Frequently Asked Questions

What is the IUPAC name of (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate?
The IUPAC name of (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate (CID 90170629) is (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate.
What is the SMILES notation for (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate?
The canonical SMILES for (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate is CC[Si](CC)(CCCN(F)C(=O)Oc1cc(F)c(F)c(F)c1F)OC.
What is the InChIKey of (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate?
The InChIKey is RFVVJLZQPSQKHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F5NO3Si/c1-4-25(5-2,23-3)8-6-7-21(20)15(22)24-11-9-10(16)12(17)14(19)13(11)18/h9H,4-8H2,1-3H3.
What are the key properties of (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate?
(2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate has a molecular weight of 385.41 g/mol, XLogP of 4.95, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,4,5-tetrafluorophenyl) N-[3-[diethyl(methoxy)silyl]propyl]-N-fluorocarbamate is sourced from PubChem (CID 90170629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).