2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine

C11H23NSi — CID 100943521

IUPAC2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine
SMILESCC(C#C[Si](C)(C)C)C(C)(C)CN
InChIInChI=1S/C11H23NSi/c1-10(11(2,3)9-12)7-8-13(4,5)6/h10H,9,12H2,1-6H3
InChIKeyFQJYWTZJEOBQDA-UHFFFAOYSA-N
MW197.40 g/mol
LogP2.49
Rot. Bonds2

About 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine

2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine (PubChem CID 100943521) has the molecular formula C11H23NSi and a molecular weight of 197.40 g/mol. Its IUPAC name is 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine.

Molecular Properties

Compound Name2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine
PubChem CID100943521
Molecular FormulaC11H23NSi
Molecular Weight197.40 g/mol
Exact Mass197.16
IUPAC Name2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine
SMILESCC(C#C[Si](C)(C)C)C(C)(C)CN
InChIInChI=1S/C11H23NSi/c1-10(11(2,3)9-12)7-8-13(4,5)6/h10H,9,12H2,1-6H3
InChIKeyFQJYWTZJEOBQDA-UHFFFAOYSA-N
XLogP2.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.40
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2R,3S)-3-methyl-5-trimethylsilylpent-4-yn-2-ol
CID 14084682
2,2-dimethylbutane-1,3-diamine
CID 22255870
(2S,3S,4S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-trimethylsilylhex-5-yn-3-ol
CID 101162769
2,2,4,4-tetramethylpentane-1,3,5-triamine
CID 88802410
3,5-dimethylhept-1-ynyl(trimethyl)silane
CID 58467900
5-amino-3,4,4-trimethylpentan-2-ol
CID 130514641
3,3-dichloro-2,2-dimethylpropan-1-amine
CID 175054384
(2R,3R)-2-methyl-5-trimethylsilylpent-4-yne-1,3-diol
CID 130659352
(3R,4S)-4-(methoxymethoxy)-2,2-dimethyl-6-trimethylsilylhex-5-yn-3-ol
CID 101156045
(3S,4S)-5-[tert-butyl(dimethyl)silyl]oxy-4-methyl-1-trimethylsilylpent-1-yn-3-ol
CID 71561744
methyl 3-amino-5-trimethylsilylpent-4-ynoate
CID 18784307
[(2S,3R,4R)-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-6-trimethylsilylhex-5-yn-3-yl] acetate
CID 101168220

Frequently Asked Questions

What is the IUPAC name of 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine?
The IUPAC name of 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine (CID 100943521) is 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine.
What is the SMILES notation for 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine?
The canonical SMILES for 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine is CC(C#C[Si](C)(C)C)C(C)(C)CN.
What is the InChIKey of 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine?
The InChIKey is FQJYWTZJEOBQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NSi/c1-10(11(2,3)9-12)7-8-13(4,5)6/h10H,9,12H2,1-6H3.
What are the key properties of 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine?
2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine has a molecular weight of 197.40 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-trimethyl-5-trimethylsilylpent-4-yn-1-amine is sourced from PubChem (CID 100943521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).