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

C5H13ClN2Si — CID 173059324

IUPACN'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine
SMILESCNCCNC=C([SiH3])Cl
InChIInChI=1S/C5H13ClN2Si/c1-7-2-3-8-4-5(6)9/h4,7-8H,2-3H2,1,9H3
InChIKeyKBKJYRBIKLHLLT-UHFFFAOYSA-N
MW164.71 g/mol
LogP-0.80
Rot. Bonds4

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

N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine (PubChem CID 173059324) has the molecular formula C5H13ClN2Si and a molecular weight of 164.71 g/mol. Its IUPAC name is N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine
PubChem CID173059324
Molecular FormulaC5H13ClN2Si
Molecular Weight164.71 g/mol
Exact Mass164.05
IUPAC NameN'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine
SMILESCNCCNC=C([SiH3])Cl
InChIInChI=1S/C5H13ClN2Si/c1-7-2-3-8-4-5(6)9/h4,7-8H,2-3H2,1,9H3
InChIKeyKBKJYRBIKLHLLT-UHFFFAOYSA-N
XLogP-0.80
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.71
LogP ≤ 5-0.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine?
The IUPAC name of N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine (CID 173059324) is N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine.
What is the SMILES notation for N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine?
The canonical SMILES for N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine is CNCCNC=C([SiH3])Cl.
What is the InChIKey of N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine?
The InChIKey is KBKJYRBIKLHLLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13ClN2Si/c1-7-2-3-8-4-5(6)9/h4,7-8H,2-3H2,1,9H3.
What are the key properties of N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine?
N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine has a molecular weight of 164.71 g/mol, XLogP of -0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-chloro-2-silylethenyl)-N-methylethane-1,2-diamine is sourced from PubChem (CID 173059324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).