4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine

C17H27NSi — CID 135004241

IUPAC4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine
SMILESCC(C)C(C#C[Si](C)(C)C)NCCc1ccccc1
InChIInChI=1S/C17H27NSi/c1-15(2)17(12-14-19(3,4)5)18-13-11-16-9-7-6-8-10-16/h6-10,15,17-18H,11,13H2,1-5H3
InChIKeySFNJJOVWUMKEAH-UHFFFAOYSA-N
MW273.50 g/mol
LogP3.72
Rot. Bonds5

About 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine

4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine (PubChem CID 135004241) has the molecular formula C17H27NSi and a molecular weight of 273.50 g/mol. Its IUPAC name is 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine.

Molecular Properties

Compound Name4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine
PubChem CID135004241
Molecular FormulaC17H27NSi
Molecular Weight273.50 g/mol
Exact Mass273.19
IUPAC Name4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine
SMILESCC(C)C(C#C[Si](C)(C)C)NCCc1ccccc1
InChIInChI=1S/C17H27NSi/c1-15(2)17(12-14-19(3,4)5)18-13-11-16-9-7-6-8-10-16/h6-10,15,17-18H,11,13H2,1-5H3
InChIKeySFNJJOVWUMKEAH-UHFFFAOYSA-N
XLogP3.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.50
LogP ≤ 53.72
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

1-phenyl-N-(2-phenylethyl)-3-trimethylsilylprop-2-yn-1-amine
CID 135004228
(3-bromo-5-phenylpent-1-ynyl)-trimethylsilane
CID 166637296
1-N,1-N'-bis(2-phenylethyl)ethane-1,1-diamine
CID 141155075
(2R)-2-(2-phenylethylamino)propanoic acid
CID 83194551
(3R)-N,N-dibenzyl-4-methyl-1-trimethylsilylpent-1-yn-3-amine
CID 102502700
N-benzyl-1-phenyl-3-trimethylsilylprop-2-yn-1-amine
CID 101180194
methane;2-methyl-1-phenyl-N-(2-phenylethyl)propan-1-amine
CID 70638594
1-chloro-N-(2-phenylethyl)propan-2-amine
CID 65025735
2-[1-(2-phenylethylamino)ethyl]phenol
CID 43194097
N-phenyl-2-(2-phenylethylamino)propanamide
CID 43083341
3-ethyl-N-(2-phenylethyl)pentan-2-amine
CID 63844116
5-methyl-N-(2-phenylethyl)hexan-2-amine
CID 43178595

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine?
The IUPAC name of 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine (CID 135004241) is 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine.
What is the SMILES notation for 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine?
The canonical SMILES for 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine is CC(C)C(C#C[Si](C)(C)C)NCCc1ccccc1.
What is the InChIKey of 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine?
The InChIKey is SFNJJOVWUMKEAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NSi/c1-15(2)17(12-14-19(3,4)5)18-13-11-16-9-7-6-8-10-16/h6-10,15,17-18H,11,13H2,1-5H3.
What are the key properties of 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine?
4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine has a molecular weight of 273.50 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-phenylethyl)-1-trimethylsilylpent-1-yn-3-amine is sourced from PubChem (CID 135004241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).