1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine

C10H22F3NOSi — CID 112548377

IUPAC1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine
SMILESCC(C)CC(N)C(O[Si](C)(C)C)C(F)(F)F
InChIInChI=1S/C10H22F3NOSi/c1-7(2)6-8(14)9(10(11,12)13)15-16(3,4)5/h7-9H,6,14H2,1-5H3
InChIKeyWAAYMAUFIAZZHT-UHFFFAOYSA-N
MW257.37 g/mol
LogP3.14
Rot. Bonds5

About 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine

1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine (PubChem CID 112548377) has the molecular formula C10H22F3NOSi and a molecular weight of 257.37 g/mol. Its IUPAC name is 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine.

Molecular Properties

Compound Name1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine
PubChem CID112548377
Molecular FormulaC10H22F3NOSi
Molecular Weight257.37 g/mol
Exact Mass257.14
IUPAC Name1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine
SMILESCC(C)CC(N)C(O[Si](C)(C)C)C(F)(F)F
InChIInChI=1S/C10H22F3NOSi/c1-7(2)6-8(14)9(10(11,12)13)15-16(3,4)5/h7-9H,6,14H2,1-5H3
InChIKeyWAAYMAUFIAZZHT-UHFFFAOYSA-N
XLogP3.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.37
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,3,3-trifluoro-1-phenyl-2-trimethylsilyloxypropan-1-amine
CID 112548376
(2S)-1,1-difluoro-4-methylpentan-2-amine
CID 130038441
1-trimethylsilyloxyethanamine
CID 87513832
(4S)-2,5-dimethylheptan-4-amine
CID 145304890
(4S,6R)-4,6-diamino-2,8-dimethylnonan-5-ol
CID 10512329
trimethyl-[(2R,4R)-4-trimethylsilyloxypentan-2-yl]oxysilane
CID 11139503
(2S,3R)-1,1,1-trifluoro-2-methoxypentan-3-amine
CID 170384161
(2S)-1-methoxy-4-methylpentane-1,2-diamine
CID 166706946
(1R,2R)-1,2-diamino-4-methylpentan-1-ol
CID 141008586
dimethyl-bis(4-methylpentan-2-yloxy)silane
CID 91733276
5,5,5-trifluoro-4-methylpentan-2-amine
CID 55254968
5-amino-2,7-dimethyloctan-4-ol
CID 54358847

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine?
The IUPAC name of 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine (CID 112548377) is 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine.
What is the SMILES notation for 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine?
The canonical SMILES for 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine is CC(C)CC(N)C(O[Si](C)(C)C)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine?
The InChIKey is WAAYMAUFIAZZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22F3NOSi/c1-7(2)6-8(14)9(10(11,12)13)15-16(3,4)5/h7-9H,6,14H2,1-5H3.
What are the key properties of 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine?
1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine has a molecular weight of 257.37 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-5-methyl-2-trimethylsilyloxyhexan-3-amine is sourced from PubChem (CID 112548377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).