3-[dichloro(ethyl)silyl]propan-1-amine

C5H13Cl2NSi — CID 20836280

IUPAC3-[dichloro(ethyl)silyl]propan-1-amine
SMILESCC[Si](Cl)(Cl)CCCN
InChIInChI=1S/C5H13Cl2NSi/c1-2-9(6,7)5-3-4-8/h2-5,8H2,1H3
InChIKeyNEESUDGGMYDIKQ-UHFFFAOYSA-N
MW186.16 g/mol
LogP2.27
Rot. Bonds4

About 3-[dichloro(ethyl)silyl]propan-1-amine

3-[dichloro(ethyl)silyl]propan-1-amine (PubChem CID 20836280) has the molecular formula C5H13Cl2NSi and a molecular weight of 186.16 g/mol. Its IUPAC name is 3-[dichloro(ethyl)silyl]propan-1-amine.

Molecular Properties

Compound Name3-[dichloro(ethyl)silyl]propan-1-amine
PubChem CID20836280
Molecular FormulaC5H13Cl2NSi
Molecular Weight186.16 g/mol
Exact Mass185.02
IUPAC Name3-[dichloro(ethyl)silyl]propan-1-amine
SMILESCC[Si](Cl)(Cl)CCCN
InChIInChI=1S/C5H13Cl2NSi/c1-2-9(6,7)5-3-4-8/h2-5,8H2,1H3
InChIKeyNEESUDGGMYDIKQ-UHFFFAOYSA-N
XLogP2.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.16
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[dichloro(ethyl)silyl]propan-1-amine?
The IUPAC name of 3-[dichloro(ethyl)silyl]propan-1-amine (CID 20836280) is 3-[dichloro(ethyl)silyl]propan-1-amine.
What is the SMILES notation for 3-[dichloro(ethyl)silyl]propan-1-amine?
The canonical SMILES for 3-[dichloro(ethyl)silyl]propan-1-amine is CC[Si](Cl)(Cl)CCCN.
What is the InChIKey of 3-[dichloro(ethyl)silyl]propan-1-amine?
The InChIKey is NEESUDGGMYDIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13Cl2NSi/c1-2-9(6,7)5-3-4-8/h2-5,8H2,1H3.
What are the key properties of 3-[dichloro(ethyl)silyl]propan-1-amine?
3-[dichloro(ethyl)silyl]propan-1-amine has a molecular weight of 186.16 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dichloro(ethyl)silyl]propan-1-amine is sourced from PubChem (CID 20836280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).