N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine

C12H22N2Si — CID 103437754

IUPACN'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine
SMILESC[Si](C)(C)c1ccc(CNCCN)cc1
InChIInChI=1S/C12H22N2Si/c1-15(2,3)12-6-4-11(5-7-12)10-14-9-8-13/h4-7,14H,8-10,13H2,1-3H3
InChIKeyJYLGLUFSTGSVEQ-UHFFFAOYSA-N
MW222.41 g/mol
LogP1.28
Rot. Bonds5

About N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine

N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine (PubChem CID 103437754) has the molecular formula C12H22N2Si and a molecular weight of 222.41 g/mol. Its IUPAC name is N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine
PubChem CID103437754
Molecular FormulaC12H22N2Si
Molecular Weight222.41 g/mol
Exact Mass222.16
IUPAC NameN'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine
SMILESC[Si](C)(C)c1ccc(CNCCN)cc1
InChIInChI=1S/C12H22N2Si/c1-15(2,3)12-6-4-11(5-7-12)10-14-9-8-13/h4-7,14H,8-10,13H2,1-3H3
InChIKeyJYLGLUFSTGSVEQ-UHFFFAOYSA-N
XLogP1.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.41
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(4-chlorophenyl)methyl]-1-(4-trimethylsilylphenyl)methanamine
CID 103437532
N'-[(4-aminophenyl)methyl]ethane-1,2-diamine
CID 13286601
2-propan-2-yloxy-N-[(4-trimethylsilylphenyl)methyl]ethanamine
CID 103438060
N-[3-[(4-trimethylsilylphenyl)methylamino]propyl]methanesulfonamide
CID 106336342
N'-[[4-[(3-aminopropylamino)methyl]phenyl]methyl]propane-1,3-diamine
CID 10106170
3-pyrrolidin-1-yl-N-[(4-trimethylsilylphenyl)methyl]propan-1-amine
CID 103437796
4-propan-2-yloxy-N-[(4-trimethylsilylphenyl)methyl]butan-1-amine
CID 106009810
2-methyl-N-[(4-trimethylsilylphenyl)methyl]propan-1-amine
CID 103437435
2-[(4-trimethylsilylphenyl)methylamino]acetamide
CID 103437528
N'-[[4-[2-[dimethoxy(methyl)silyl]ethyl]phenyl]methyl]ethane-1,2-diamine
CID 20829624
methyl 3-[(4-trimethylsilylphenyl)methylamino]propanoate
CID 103437611
N'-[[4-[4-[(2-aminoethylamino)methyl]phenoxy]phenyl]methyl]ethane-1,2-diamine
CID 154146125

Frequently Asked Questions

What is the IUPAC name of N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine?
The IUPAC name of N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine (CID 103437754) is N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine.
What is the SMILES notation for N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine?
The canonical SMILES for N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine is C[Si](C)(C)c1ccc(CNCCN)cc1.
What is the InChIKey of N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine?
The InChIKey is JYLGLUFSTGSVEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2Si/c1-15(2,3)12-6-4-11(5-7-12)10-14-9-8-13/h4-7,14H,8-10,13H2,1-3H3.
What are the key properties of N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine?
N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine has a molecular weight of 222.41 g/mol, XLogP of 1.28, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(4-trimethylsilylphenyl)methyl]ethane-1,2-diamine is sourced from PubChem (CID 103437754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).