trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane

C26H55NOSi — CID 101449270

IUPACtrimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane
SMILESCCCCCCCCCC(CCCCCCCCC)(O[Si](C)(C)C)[C@@H]1CCCN1
InChIInChI=1S/C26H55NOSi/c1-6-8-10-12-14-16-18-22-26(28-29(3,4)5,25-21-20-24-27-25)23-19-17-15-13-11-9-7-2/h25,27H,6-24H2,1-5H3/t25-/m0/s1
InChIKeyCVQQFAFOJNSZLU-VWLOTQADSA-N
MW425.82 g/mol
LogP8.61
Rot. Bonds19

About trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane

trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane (PubChem CID 101449270) has the molecular formula C26H55NOSi and a molecular weight of 425.82 g/mol. Its IUPAC name is trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane.

Molecular Properties

Compound Nametrimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane
PubChem CID101449270
Molecular FormulaC26H55NOSi
Molecular Weight425.82 g/mol
Exact Mass425.41
IUPAC Nametrimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane
SMILESCCCCCCCCCC(CCCCCCCCC)(O[Si](C)(C)C)[C@@H]1CCCN1
InChIInChI=1S/C26H55NOSi/c1-6-8-10-12-14-16-18-22-26(28-29(3,4)5,25-21-20-24-27-25)23-19-17-15-13-11-9-7-2/h25,27H,6-24H2,1-5H3/t25-/m0/s1
InChIKeyCVQQFAFOJNSZLU-VWLOTQADSA-N
XLogP8.61
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.82
LogP ≤ 58.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[bis[3,5-bis(fluoromethyl)phenyl]-[(2S)-pyrrolidin-2-yl]methoxy]-trimethylsilane
CID 142685120
(2R)-2-[bis[3,5-bis(trifluoromethyl)phenyl]-(5-butyl-14,14-dimethyloctadecan-5-yl)oxymethyl]pyrrolidine
CID 152604508
[dinaphthalen-1-yl(pyrrolidin-2-yl)methoxy]-trimethylsilane
CID 69476600
hexyl pyrrolidin-2-yl carbonate
CID 54505278
trimethyl-(1-silyloxy-1-trimethylsilyloxyundecoxy)silane
CID 123304582
(2S)-2-hexylpyrrolidine
CID 7047826
7-pyrrolidin-2-yltrideca-5,8-diyn-7-ol
CID 76525940
nonan-3-yl pyrrolidin-2-yl carbonate
CID 54338103
(2R)-2-(octoxymethyl)pyrrolidine
CID 102820024
2-[9-[9-(oxiran-2-yl)nonadecan-9-yloxy]nonadecan-9-yl]oxirane
CID 118162349
2-piperidin-3-yloctan-2-ol
CID 65146111
(2S)-2-[2-[(2-methylpropan-2-yl)oxy]propan-2-yl]pyrrolidine
CID 176610737

Frequently Asked Questions

What is the IUPAC name of trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane?
The IUPAC name of trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane (CID 101449270) is trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane.
What is the SMILES notation for trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane?
The canonical SMILES for trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane is CCCCCCCCCC(CCCCCCCCC)(O[Si](C)(C)C)[C@@H]1CCCN1.
What is the InChIKey of trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane?
The InChIKey is CVQQFAFOJNSZLU-VWLOTQADSA-N. The full InChI is InChI=1S/C26H55NOSi/c1-6-8-10-12-14-16-18-22-26(28-29(3,4)5,25-21-20-24-27-25)23-19-17-15-13-11-9-7-2/h25,27H,6-24H2,1-5H3/t25-/m0/s1.
What are the key properties of trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane?
trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane has a molecular weight of 425.82 g/mol, XLogP of 8.61, 19 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[10-[(2S)-pyrrolidin-2-yl]nonadecan-10-yloxy]silane is sourced from PubChem (CID 101449270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).