N-[butyl-chloro-(dimethylamino)silyl]ethanamine

C8H21ClN2Si — CID 87335092

IUPACN-[butyl-chloro-(dimethylamino)silyl]ethanamine
SMILESCCCC[Si](Cl)(NCC)N(C)C
InChIInChI=1S/C8H21ClN2Si/c1-5-7-8-12(9,10-6-2)11(3)4/h10H,5-8H2,1-4H3
InChIKeyMPUVJMGEIOPEEM-UHFFFAOYSA-N
MW208.81 g/mol
LogP2.14
Rot. Bonds6

About N-[butyl-chloro-(dimethylamino)silyl]ethanamine

N-[butyl-chloro-(dimethylamino)silyl]ethanamine (PubChem CID 87335092) has the molecular formula C8H21ClN2Si and a molecular weight of 208.81 g/mol. Its IUPAC name is N-[butyl-chloro-(dimethylamino)silyl]ethanamine.

Molecular Properties

Compound NameN-[butyl-chloro-(dimethylamino)silyl]ethanamine
PubChem CID87335092
Molecular FormulaC8H21ClN2Si
Molecular Weight208.81 g/mol
Exact Mass208.12
IUPAC NameN-[butyl-chloro-(dimethylamino)silyl]ethanamine
SMILESCCCC[Si](Cl)(NCC)N(C)C
InChIInChI=1S/C8H21ClN2Si/c1-5-7-8-12(9,10-6-2)11(3)4/h10H,5-8H2,1-4H3
InChIKeyMPUVJMGEIOPEEM-UHFFFAOYSA-N
XLogP2.14
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.81
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[butyl-(dimethylamino)-propylsilyl]ethanamine
CID 87334291
N-methyl-N-tributylsilylmethanamine
CID 21329544
dibutyl-chloro-[4-[dibutyl(chloro)silyl]butyl]silane
CID 87144873
1-[[(butyl-chloro-methylsilyl)amino]-chloro-methylsilyl]butane
CID 141041287
N-[dichloro(methyl)silyl]ethanamine
CID 87336020
butyl-dichloro-octylsilane
CID 140745133
butyl-chloro-methyl-pentylsilane
CID 87411075
dibutyl-chloro-[chloro(dimethyl)silyl]silane
CID 71420046
N-[ethylamino-bis(methylamino)silyl]-N-methylbutan-1-amine
CID 87081959
N-(butyl-chloro-propan-2-ylsilyl)methanamine
CID 87335233
N-(butyl-ethenyl-propan-2-ylsilyl)ethanamine
CID 87364009
N-[bis(ethylamino)-methylsilyl]ethanamine
CID 21245362

Frequently Asked Questions

What is the IUPAC name of N-[butyl-chloro-(dimethylamino)silyl]ethanamine?
The IUPAC name of N-[butyl-chloro-(dimethylamino)silyl]ethanamine (CID 87335092) is N-[butyl-chloro-(dimethylamino)silyl]ethanamine.
What is the SMILES notation for N-[butyl-chloro-(dimethylamino)silyl]ethanamine?
The canonical SMILES for N-[butyl-chloro-(dimethylamino)silyl]ethanamine is CCCC[Si](Cl)(NCC)N(C)C.
What is the InChIKey of N-[butyl-chloro-(dimethylamino)silyl]ethanamine?
The InChIKey is MPUVJMGEIOPEEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21ClN2Si/c1-5-7-8-12(9,10-6-2)11(3)4/h10H,5-8H2,1-4H3.
What are the key properties of N-[butyl-chloro-(dimethylamino)silyl]ethanamine?
N-[butyl-chloro-(dimethylamino)silyl]ethanamine has a molecular weight of 208.81 g/mol, XLogP of 2.14, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl-chloro-(dimethylamino)silyl]ethanamine is sourced from PubChem (CID 87335092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).