9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate

C24H25NO2Si — CID 54486413

IUPAC9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate
SMILESC[Si](C)(C)N(C(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1
InChIInChI=1S/C24H25NO2Si/c1-28(2,3)25(18-11-5-4-6-12-18)24(26)27-17-23-21-15-9-7-13-19(21)20-14-8-10-16-22(20)23/h4-16,23H,17H2,1-3H3
InChIKeyXSQBIGQNMFYRJO-UHFFFAOYSA-N
MW387.56 g/mol
LogP6.28
Rot. Bonds4

About 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate

9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate (PubChem CID 54486413) has the molecular formula C24H25NO2Si and a molecular weight of 387.56 g/mol. Its IUPAC name is 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate.

Molecular Properties

Compound Name9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate
PubChem CID54486413
Molecular FormulaC24H25NO2Si
Molecular Weight387.56 g/mol
Exact Mass387.17
IUPAC Name9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate
SMILESC[Si](C)(C)N(C(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1
InChIInChI=1S/C24H25NO2Si/c1-28(2,3)25(18-11-5-4-6-12-18)24(26)27-17-23-21-15-9-7-13-19(21)20-14-8-10-16-22(20)23/h4-16,23H,17H2,1-3H3
InChIKeyXSQBIGQNMFYRJO-UHFFFAOYSA-N
XLogP6.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.56
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9H-fluoren-9-ylmethyl N-amino-N-phenylcarbamate
CID 155637511
9H-fluoren-9-ylmethyl N-phenyl-N-propanoylcarbamate
CID 54097976
9H-fluoren-9-ylmethyl N-amino-N-methylcarbamate
CID 10563828
(2R)-2-[N-(9H-fluoren-9-ylmethoxycarbonyl)anilino]-2-phenylpropanoic acid
CID 67594296
9H-fluoren-9-ylmethyl N-hydroxy-N-propylcarbamate
CID 86810454
2-[amino(9H-fluoren-9-ylmethoxycarbonyl)amino]acetic acid
CID 173067102
2-[9H-fluoren-9-ylmethoxycarbonyl(methoxycarbonyl)amino]propanoic acid
CID 174989747
2-[ethoxy(9H-fluoren-9-ylmethoxycarbonyl)amino]acetic acid
CID 176719721
(2S)-2-[N-(9H-fluoren-9-ylmethoxycarbonyl)anilino]hexanoic acid
CID 175700602
2-[9H-fluoren-9-ylmethoxycarbonyl(1-hydroxyethyl)amino]acetic acid
CID 22364292
(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl((113C)methyl)(15N)amino]-3-(113C)methyl(1,2,3,4-13C4)butanoic acid
CID 117065495
(2S)-3-(9H-fluoren-9-ylmethoxy)-2-methyl-3-oxo-2-(N-phenylanilino)propanoic acid
CID 68509314

Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate?
The IUPAC name of 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate (CID 54486413) is 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate.
What is the SMILES notation for 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate?
The canonical SMILES for 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate is C[Si](C)(C)N(C(=O)OCC1c2ccccc2-c2ccccc21)c1ccccc1.
What is the InChIKey of 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate?
The InChIKey is XSQBIGQNMFYRJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO2Si/c1-28(2,3)25(18-11-5-4-6-12-18)24(26)27-17-23-21-15-9-7-13-19(21)20-14-8-10-16-22(20)23/h4-16,23H,17H2,1-3H3.
What are the key properties of 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate?
9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate has a molecular weight of 387.56 g/mol, XLogP of 6.28, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-9-ylmethyl N-phenyl-N-trimethylsilylcarbamate is sourced from PubChem (CID 54486413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).