N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine

C7H18ClNSi — CID 15900861

IUPACN-[chloromethyl(dimethyl)silyl]-N-ethylethanamine
SMILESCCN(CC)[Si](C)(C)CCl
InChIInChI=1S/C7H18ClNSi/c1-5-9(6-2)10(3,4)7-8/h5-7H2,1-4H3
InChIKeyRVGSZVBVIANKMA-UHFFFAOYSA-N
MW179.77 g/mol
LogP2.31
Rot. Bonds4

About N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine

N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine (PubChem CID 15900861) has the molecular formula C7H18ClNSi and a molecular weight of 179.77 g/mol. Its IUPAC name is N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[chloromethyl(dimethyl)silyl]-N-ethylethanamine
PubChem CID15900861
Molecular FormulaC7H18ClNSi
Molecular Weight179.77 g/mol
Exact Mass179.09
IUPAC NameN-[chloromethyl(dimethyl)silyl]-N-ethylethanamine
SMILESCCN(CC)[Si](C)(C)CCl
InChIInChI=1S/C7H18ClNSi/c1-5-9(6-2)10(3,4)7-8/h5-7H2,1-4H3
InChIKeyRVGSZVBVIANKMA-UHFFFAOYSA-N
XLogP2.31
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.77
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine?
The IUPAC name of N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine (CID 15900861) is N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine.
What is the SMILES notation for N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine?
The canonical SMILES for N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine is CCN(CC)[Si](C)(C)CCl.
What is the InChIKey of N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine?
The InChIKey is RVGSZVBVIANKMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18ClNSi/c1-5-9(6-2)10(3,4)7-8/h5-7H2,1-4H3.
What are the key properties of N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine?
N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine has a molecular weight of 179.77 g/mol, XLogP of 2.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[chloromethyl(dimethyl)silyl]-N-ethylethanamine is sourced from PubChem (CID 15900861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).