1-trimethylsilylprop-2-yn-1-amine

C6H13NSi — CID 151117017

IUPAC1-trimethylsilylprop-2-yn-1-amine
SMILESC#CC(N)[Si](C)(C)C
InChIInChI=1S/C6H13NSi/c1-5-6(7)8(2,3)4/h1,6H,7H2,2-4H3
InChIKeyMRJLETLCLLIQPD-UHFFFAOYSA-N
MW127.26 g/mol
LogP0.82
Rot. Bonds1

About 1-trimethylsilylprop-2-yn-1-amine

1-trimethylsilylprop-2-yn-1-amine (PubChem CID 151117017) has the molecular formula C6H13NSi and a molecular weight of 127.26 g/mol. Its IUPAC name is 1-trimethylsilylprop-2-yn-1-amine.

Molecular Properties

Compound Name1-trimethylsilylprop-2-yn-1-amine
PubChem CID151117017
Molecular FormulaC6H13NSi
Molecular Weight127.26 g/mol
Exact Mass127.08
IUPAC Name1-trimethylsilylprop-2-yn-1-amine
SMILESC#CC(N)[Si](C)(C)C
InChIInChI=1S/C6H13NSi/c1-5-6(7)8(2,3)4/h1,6H,7H2,2-4H3
InChIKeyMRJLETLCLLIQPD-UHFFFAOYSA-N
XLogP0.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.26
LogP ≤ 50.82
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

(3S)-4-methylpent-1-yn-3-amine
CID 11579133
hex-1-yn-3-yl(trimethyl)silane
CID 10464603
pent-1-yn-3-amine;hydrochloride
CID 75480843
4,4-dimethylpent-1-yn-3-amine;hydrochloride
CID 119031411
hept-1-yn-3-yl(trimethyl)silane
CID 13406629
trimethyl(oct-1-yn-3-yl)silane
CID 13199502
(3R,4R)-4-methylhex-1-yn-3-amine
CID 130642169
1-N,1-N-dimethylbut-3-yne-1,2-diamine
CID 79095341
1-trimethylsilylprop-2-ynyl hydrogen sulfate
CID 155670240
1-[tert-butyl(dimethyl)silyl]prop-2-yn-1-ol
CID 15500749
2-amino-3-methylpent-4-yn-1-ol
CID 123553773
(2R,3R)-3-trimethylsilylhex-4-yn-2-amine
CID 131168914

Frequently Asked Questions

What is the IUPAC name of 1-trimethylsilylprop-2-yn-1-amine?
The IUPAC name of 1-trimethylsilylprop-2-yn-1-amine (CID 151117017) is 1-trimethylsilylprop-2-yn-1-amine.
What is the SMILES notation for 1-trimethylsilylprop-2-yn-1-amine?
The canonical SMILES for 1-trimethylsilylprop-2-yn-1-amine is C#CC(N)[Si](C)(C)C.
What is the InChIKey of 1-trimethylsilylprop-2-yn-1-amine?
The InChIKey is MRJLETLCLLIQPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NSi/c1-5-6(7)8(2,3)4/h1,6H,7H2,2-4H3.
What are the key properties of 1-trimethylsilylprop-2-yn-1-amine?
1-trimethylsilylprop-2-yn-1-amine has a molecular weight of 127.26 g/mol, XLogP of 0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-trimethylsilylprop-2-yn-1-amine is sourced from PubChem (CID 151117017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).