2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine

C17H31NSi — CID 106323109

IUPAC2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine
SMILESCC(C)CNCC(Cc1ccccc1)C[Si](C)(C)C
InChIInChI=1S/C17H31NSi/c1-15(2)12-18-13-17(14-19(3,4)5)11-16-9-7-6-8-10-16/h6-10,15,17-18H,11-14H2,1-5H3
InChIKeyYEDKBUNOCBPNPV-UHFFFAOYSA-N
MW277.53 g/mol
LogP4.43
Rot. Bonds8

About 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine

2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine (PubChem CID 106323109) has the molecular formula C17H31NSi and a molecular weight of 277.53 g/mol. Its IUPAC name is 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine.

Molecular Properties

Compound Name2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine
PubChem CID106323109
Molecular FormulaC17H31NSi
Molecular Weight277.53 g/mol
Exact Mass277.22
IUPAC Name2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine
SMILESCC(C)CNCC(Cc1ccccc1)C[Si](C)(C)C
InChIInChI=1S/C17H31NSi/c1-15(2)12-18-13-17(14-19(3,4)5)11-16-9-7-6-8-10-16/h6-10,15,17-18H,11-14H2,1-5H3
InChIKeyYEDKBUNOCBPNPV-UHFFFAOYSA-N
XLogP4.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.53
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-benzyl-N-(2-methylpropyl)-3-phenylpropan-1-amine
CID 63496022
2-benzyl-4-methoxy-N-(2-methylpropyl)butan-1-amine
CID 62530667
2-benzyl-3-(2-methylphenyl)-N-(2-methylpropyl)propan-1-amine
CID 63496197
2-benzyl-3-(4-bromothiophen-2-yl)-N-(2-methylpropyl)propan-1-amine
CID 63496906
2-benzyl-4-methyl-N-(2-methylpropyl)heptan-1-amine
CID 63496731
2-benzyl-5-methoxy-5-methyl-N-(2-methylpropyl)hexan-1-amine
CID 103036646
2-[(4-bromophenyl)methyl]-N-ethyl-3-trimethylsilylpropan-1-amine
CID 114173520
N-benzyl-2-methylpropan-1-amine;ethane
CID 142079167
2-benzyl-3-phenyl-N-propylpropan-1-amine
CID 62530255
2-[(4-chlorophenyl)methyl]-N-propan-2-yl-3-trimethylsilylpropan-1-amine
CID 106323200
2-[(4-bromophenyl)methyl]-N-propan-2-yl-3-trimethylsilylpropan-1-amine
CID 106323210
2-[(3-bromophenyl)methyl]-N-propan-2-yl-3-trimethylsilylpropan-1-amine
CID 106323271

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine?
The IUPAC name of 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine (CID 106323109) is 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine.
What is the SMILES notation for 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine?
The canonical SMILES for 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine is CC(C)CNCC(Cc1ccccc1)C[Si](C)(C)C.
What is the InChIKey of 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine?
The InChIKey is YEDKBUNOCBPNPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31NSi/c1-15(2)12-18-13-17(14-19(3,4)5)11-16-9-7-6-8-10-16/h6-10,15,17-18H,11-14H2,1-5H3.
What are the key properties of 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine?
2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine has a molecular weight of 277.53 g/mol, XLogP of 4.43, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-(2-methylpropyl)-3-trimethylsilylpropan-1-amine is sourced from PubChem (CID 106323109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).