1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine

C6H17ClN2Si — CID 173059034

IUPAC1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine
SMILESCCN(CC)C([SiH3])(Cl)NC
InChIInChI=1S/C6H17ClN2Si/c1-4-9(5-2)6(7,10)8-3/h8H,4-5H2,1-3,10H3
InChIKeyGIVJIIZLLVHHOW-UHFFFAOYSA-N
MW180.75 g/mol
LogP-0.24
Rot. Bonds4

About 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine

1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine (PubChem CID 173059034) has the molecular formula C6H17ClN2Si and a molecular weight of 180.75 g/mol. Its IUPAC name is 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine.

Molecular Properties

Compound Name1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine
PubChem CID173059034
Molecular FormulaC6H17ClN2Si
Molecular Weight180.75 g/mol
Exact Mass180.08
IUPAC Name1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine
SMILESCCN(CC)C([SiH3])(Cl)NC
InChIInChI=1S/C6H17ClN2Si/c1-4-9(5-2)6(7,10)8-3/h8H,4-5H2,1-3,10H3
InChIKeyGIVJIIZLLVHHOW-UHFFFAOYSA-N
XLogP-0.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.75
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-N,N-diethyl-2,2-dimethyl-1-silylpropan-1-amine
CID 173064950
1-chloro-N-methyl-1-silylethanamine
CID 173059488
2-chloro-N,N-diethyl-1-silylpropan-2-amine
CID 173059259
1,1-dichloro-N,N-diethyl-2,2-dimethylpropan-1-amine
CID 10013395
1-chloro-1-ethoxy-N,N-diethylethanamine
CID 174431336
1-chloro-N,N,2-trimethyl-1-silylbutan-1-amine
CID 173059522
1-N,1-N,1-N',1-N',1-N",1-N"-hexaethylpropane-1,1,1-triamine
CID 174059881
2-chloro-N,4-dimethyl-3-silylhexan-3-amine
CID 173065106
1-chloro-1-N-ethyl-1-N',1-N',2-trimethyl-2-silylpropane-1,1-diamine
CID 173059198
1-N,1-N',2-trimethyl-1-silylbutane-1,1-diamine
CID 173002241
1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 62848035
2-[[ethyl(methyl)amino]-methylamino]-N-methylpropan-2-amine
CID 129155610

Frequently Asked Questions

What is the IUPAC name of 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine?
The IUPAC name of 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine (CID 173059034) is 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine.
What is the SMILES notation for 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine?
The canonical SMILES for 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine is CCN(CC)C([SiH3])(Cl)NC.
What is the InChIKey of 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine?
The InChIKey is GIVJIIZLLVHHOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17ClN2Si/c1-4-9(5-2)6(7,10)8-3/h8H,4-5H2,1-3,10H3.
What are the key properties of 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine?
1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine has a molecular weight of 180.75 g/mol, XLogP of -0.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-N',N'-diethyl-N-methyl-1-silylmethanediamine is sourced from PubChem (CID 173059034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).