N-(4-trimethylsilylbutyl)aniline

C13H23NSi — CID 172713134

IUPACN-(4-trimethylsilylbutyl)aniline
SMILESC[Si](C)(C)CCCCNc1ccccc1
InChIInChI=1S/C13H23NSi/c1-15(2,3)12-8-7-11-14-13-9-5-4-6-10-13/h4-6,9-10,14H,7-8,11-12H2,1-3H3
InChIKeyFMWDNDJIUXPSPG-UHFFFAOYSA-N
MW221.42 g/mol
LogP4.22
Rot. Bonds6

About N-(4-trimethylsilylbutyl)aniline

N-(4-trimethylsilylbutyl)aniline (PubChem CID 172713134) has the molecular formula C13H23NSi and a molecular weight of 221.42 g/mol. Its IUPAC name is N-(4-trimethylsilylbutyl)aniline.

Molecular Properties

Compound NameN-(4-trimethylsilylbutyl)aniline
PubChem CID172713134
Molecular FormulaC13H23NSi
Molecular Weight221.42 g/mol
Exact Mass221.16
IUPAC NameN-(4-trimethylsilylbutyl)aniline
SMILESC[Si](C)(C)CCCCNc1ccccc1
InChIInChI=1S/C13H23NSi/c1-15(2,3)12-8-7-11-14-13-9-5-4-6-10-13/h4-6,9-10,14H,7-8,11-12H2,1-3H3
InChIKeyFMWDNDJIUXPSPG-UHFFFAOYSA-N
XLogP4.22
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.42
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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,N'-diphenylpropane-1,3-diamine;hydrochloride
CID 68721632
N-nonadecylaniline
CID 54509054
N-[5-[ethyl(dimethoxy)silyl]pentyl]aniline
CID 142705911
N-heptylaniline;hydrate
CID 174886464
N-(3-trihydroxysilylpropyl)aniline
CID 140901816
N-(4-methoxybutyl)aniline
CID 13042774
N-(trimethylsilylmethyl)aniline
CID 15743444
N-(5-bromopentyl)aniline
CID 20759134
10-anilinodecan-1-ol
CID 10955954
N'-phenylheptane-1,7-diamine
CID 61149618
CID 165388786
CID 165388786
N-[4-[3-anilinopropyl(dimethoxy)silyl]oxybutyl]aniline
CID 151955793

Frequently Asked Questions

What is the IUPAC name of N-(4-trimethylsilylbutyl)aniline?
The IUPAC name of N-(4-trimethylsilylbutyl)aniline (CID 172713134) is N-(4-trimethylsilylbutyl)aniline.
What is the SMILES notation for N-(4-trimethylsilylbutyl)aniline?
The canonical SMILES for N-(4-trimethylsilylbutyl)aniline is C[Si](C)(C)CCCCNc1ccccc1.
What is the InChIKey of N-(4-trimethylsilylbutyl)aniline?
The InChIKey is FMWDNDJIUXPSPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NSi/c1-15(2,3)12-8-7-11-14-13-9-5-4-6-10-13/h4-6,9-10,14H,7-8,11-12H2,1-3H3.
What are the key properties of N-(4-trimethylsilylbutyl)aniline?
N-(4-trimethylsilylbutyl)aniline has a molecular weight of 221.42 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-trimethylsilylbutyl)aniline is sourced from PubChem (CID 172713134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).