N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine

C13H24N2Si — CID 122164959

IUPACN'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine
SMILESC[Si](C)(C)CN(CCN)Cc1ccccc1
InChIInChI=1S/C13H24N2Si/c1-16(2,3)12-15(10-9-14)11-13-7-5-4-6-8-13/h4-8H,9-12,14H2,1-3H3
InChIKeyOIVATBFWYNCAKW-UHFFFAOYSA-N
MW236.43 g/mol
LogP2.32
Rot. Bonds6

About N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine

N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine (PubChem CID 122164959) has the molecular formula C13H24N2Si and a molecular weight of 236.43 g/mol. Its IUPAC name is N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine
PubChem CID122164959
Molecular FormulaC13H24N2Si
Molecular Weight236.43 g/mol
Exact Mass236.17
IUPAC NameN'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine
SMILESC[Si](C)(C)CN(CCN)Cc1ccccc1
InChIInChI=1S/C13H24N2Si/c1-16(2,3)12-15(10-9-14)11-13-7-5-4-6-8-13/h4-8H,9-12,14H2,1-3H3
InChIKeyOIVATBFWYNCAKW-UHFFFAOYSA-N
XLogP2.32
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.43
LogP ≤ 52.32
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

N',N'-dibenzylethane-1,2-diamine;hydrochloride
CID 6460674
(2R)-1-N-benzyl-1-N-(trimethylsilylmethyl)propane-1,2-diamine
CID 155775630
2-[benzyl(trimethylsilylmethyl)amino]acetonitrile
CID 560960
N',N'-dibenzylethane-1,2-diamine;ethenamine
CID 67896793
N'-benzyl-N'-[(3-methylphenyl)methyl]ethane-1,2-diamine
CID 39357118
N'-benzyl-N'-hexadecylethane-1,2-diamine
CID 22067437
N'-benzyl-N'-[(3-methyl-1,2-oxazol-5-yl)methyl]ethane-1,2-diamine
CID 106511670
N'-benzyl-N'-(2,2-diphenylethyl)ethane-1,2-diamine
CID 23995073
N'-benzyl-N'-(thiadiazol-5-ylmethyl)ethane-1,2-diamine
CID 130600119
N'-benzyl-N'-(2-methylsulfonylethyl)ethane-1,2-diamine
CID 61014687
N'-benzyl-N'-methylethane-1,2-diamine
CID 3014812
N'-[2-[2-aminoethyl(benzyl)amino]ethyl]ethane-1,2-diamine
CID 101461919

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine?
The IUPAC name of N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine (CID 122164959) is N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine?
The canonical SMILES for N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine is C[Si](C)(C)CN(CCN)Cc1ccccc1.
What is the InChIKey of N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine?
The InChIKey is OIVATBFWYNCAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2Si/c1-16(2,3)12-15(10-9-14)11-13-7-5-4-6-8-13/h4-8H,9-12,14H2,1-3H3.
What are the key properties of N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine?
N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine has a molecular weight of 236.43 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N'-(trimethylsilylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 122164959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).