[1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine

C16H28N2Si — CID 103438148

IUPAC[1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine
SMILESC[Si](C)(C)c1ccc(CN2CCCC(CN)C2)cc1
InChIInChI=1S/C16H28N2Si/c1-19(2,3)16-8-6-14(7-9-16)12-18-10-4-5-15(11-17)13-18/h6-9,15H,4-5,10-13,17H2,1-3H3
InChIKeyPEHTUECFBWYFDU-UHFFFAOYSA-N
MW276.50 g/mol
LogP2.40
Rot. Bonds4

About [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine

[1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine (PubChem CID 103438148) has the molecular formula C16H28N2Si and a molecular weight of 276.50 g/mol. Its IUPAC name is [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine
PubChem CID103438148
Molecular FormulaC16H28N2Si
Molecular Weight276.50 g/mol
Exact Mass276.20
IUPAC Name[1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine
SMILESC[Si](C)(C)c1ccc(CN2CCCC(CN)C2)cc1
InChIInChI=1S/C16H28N2Si/c1-19(2,3)16-8-6-14(7-9-16)12-18-10-4-5-15(11-17)13-18/h6-9,15H,4-5,10-13,17H2,1-3H3
InChIKeyPEHTUECFBWYFDU-UHFFFAOYSA-N
XLogP2.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.50
LogP ≤ 52.40
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

[1-[(4-trimethylsilylphenyl)methyl]pyrrolidin-3-yl]methanamine
CID 103438151
[1-[(4-chlorophenyl)methyl]piperidin-3-yl]methanamine
CID 18426222
[(3R)-1-[(4-methoxyphenyl)methyl]piperidin-3-yl]methanamine
CID 42253835
[(3S)-1-[(4-ethenylphenyl)methyl]piperidin-3-yl]methanamine
CID 129493697
4-[[3-(aminomethyl)piperidin-1-yl]methyl]-N,N-diethylaniline
CID 54793813
[1-[[4-(difluoromethyl)phenyl]methyl]piperidin-3-yl]methanamine;hydrochloride
CID 120836624
4-[[3-(aminomethyl)piperidin-1-yl]methyl]benzonitrile;hydrochloride
CID 66569597
(1-benzylazepan-3-yl)methanamine
CID 15718476
[(3R)-1-[(6-bromo-3-pyridinyl)methyl]piperidin-3-yl]methanamine
CID 97165519
[1-[[4-(2-methylpropoxy)phenyl]methyl]piperidin-3-yl]methanamine
CID 54794603
2-[1-[(4-chlorophenyl)methyl]piperidin-3-yl]ethanamine;hydrochloride
CID 120728185
[(3R)-1-[(2,6-dichlorophenyl)methyl]piperidin-3-yl]methanamine
CID 86313839

Frequently Asked Questions

What is the IUPAC name of [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine?
The IUPAC name of [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine (CID 103438148) is [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine.
What is the SMILES notation for [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine?
The canonical SMILES for [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine is C[Si](C)(C)c1ccc(CN2CCCC(CN)C2)cc1.
What is the InChIKey of [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine?
The InChIKey is PEHTUECFBWYFDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2Si/c1-19(2,3)16-8-6-14(7-9-16)12-18-10-4-5-15(11-17)13-18/h6-9,15H,4-5,10-13,17H2,1-3H3.
What are the key properties of [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine?
[1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine has a molecular weight of 276.50 g/mol, XLogP of 2.40, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(4-trimethylsilylphenyl)methyl]piperidin-3-yl]methanamine is sourced from PubChem (CID 103438148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).