N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine

C14H23NSi — CID 170495970

IUPACN-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine
SMILESCNCCC=Cc1cccc([Si](C)(C)C)c1
InChIInChI=1S/C14H23NSi/c1-15-11-6-5-8-13-9-7-10-14(12-13)16(2,3)4/h5,7-10,12,15H,6,11H2,1-4H3
InChIKeyDPSDFICQBKJWOK-UHFFFAOYSA-N
MW233.43 g/mol
LogP2.85
Rot. Bonds5

About N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine

N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine (PubChem CID 170495970) has the molecular formula C14H23NSi and a molecular weight of 233.43 g/mol. Its IUPAC name is N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine.

Molecular Properties

Compound NameN-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine
PubChem CID170495970
Molecular FormulaC14H23NSi
Molecular Weight233.43 g/mol
Exact Mass233.16
IUPAC NameN-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine
SMILESCNCCC=Cc1cccc([Si](C)(C)C)c1
InChIInChI=1S/C14H23NSi/c1-15-11-6-5-8-13-9-7-10-14(12-13)16(2,3)4/h5,7-10,12,15H,6,11H2,1-4H3
InChIKeyDPSDFICQBKJWOK-UHFFFAOYSA-N
XLogP2.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.43
LogP ≤ 52.85
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

4-(3-ethynylphenyl)-N-methylbut-3-en-1-amine
CID 170495317
(E)-N-methyl-4-(3-propylphenyl)but-3-en-1-amine
CID 116546325
benzyl N-[4-(3-trimethylsilylphenyl)but-3-enyl]carbamate
CID 170494266
N-[3-(3-trimethylsilylphenyl)prop-2-enyl]acetamide
CID 169465674
3-[4-(methylamino)but-1-enyl]benzenecarbothioamide
CID 170495747
N-methyl-4-[3-(trifluoromethoxy)phenyl]but-3-en-1-amine
CID 79591557
4-(6-chloro-2-pyridinyl)-N-methylbut-3-en-1-amine
CID 170495248
2,2,2-trifluoro-1-[3-[4-(methylamino)but-1-enyl]phenyl]ethanone
CID 170496577
methyl 2-[3-[4-(methylamino)but-1-enyl]phenyl]acetate
CID 170496282
4-(2-chloro-4-pyridinyl)-N-methylbut-3-en-1-amine
CID 170495263
5-[4-(methylamino)but-1-enyl]pyrimidin-2-amine
CID 170495291
4-[4-(aminomethyl)phenyl]-N-methylbut-3-en-1-amine
CID 170495473

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine?
The IUPAC name of N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine (CID 170495970) is N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine.
What is the SMILES notation for N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine?
The canonical SMILES for N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine is CNCCC=Cc1cccc([Si](C)(C)C)c1.
What is the InChIKey of N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine?
The InChIKey is DPSDFICQBKJWOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NSi/c1-15-11-6-5-8-13-9-7-10-14(12-13)16(2,3)4/h5,7-10,12,15H,6,11H2,1-4H3.
What are the key properties of N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine?
N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine has a molecular weight of 233.43 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(3-trimethylsilylphenyl)but-3-en-1-amine is sourced from PubChem (CID 170495970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).