1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine

C5H13ClN2Si — CID 173059325

IUPAC1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine
SMILESCNC(C)NC=C([SiH3])Cl
InChIInChI=1S/C5H13ClN2Si/c1-4(7-2)8-3-5(6)9/h3-4,7-8H,1-2,9H3
InChIKeyPCPBXFUZQYUVMQ-UHFFFAOYSA-N
MW164.71 g/mol
LogP-0.46
Rot. Bonds3

About 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine

1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine (PubChem CID 173059325) has the molecular formula C5H13ClN2Si and a molecular weight of 164.71 g/mol. Its IUPAC name is 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine.

Molecular Properties

Compound Name1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine
PubChem CID173059325
Molecular FormulaC5H13ClN2Si
Molecular Weight164.71 g/mol
Exact Mass164.05
IUPAC Name1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine
SMILESCNC(C)NC=C([SiH3])Cl
InChIInChI=1S/C5H13ClN2Si/c1-4(7-2)8-3-5(6)9/h3-4,7-8H,1-2,9H3
InChIKeyPCPBXFUZQYUVMQ-UHFFFAOYSA-N
XLogP-0.46
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.71
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine?
The IUPAC name of 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine (CID 173059325) is 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine.
What is the SMILES notation for 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine?
The canonical SMILES for 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine is CNC(C)NC=C([SiH3])Cl.
What is the InChIKey of 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine?
The InChIKey is PCPBXFUZQYUVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13ClN2Si/c1-4(7-2)8-3-5(6)9/h3-4,7-8H,1-2,9H3.
What are the key properties of 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine?
1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine has a molecular weight of 164.71 g/mol, XLogP of -0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-(2-chloro-2-silylethenyl)-1-N-methylethane-1,1-diamine is sourced from PubChem (CID 173059325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).