N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine

C9H12Cl3NSi — CID 12521902

IUPACN,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine
SMILESCN(C)C(c1ccccc1)[Si](Cl)(Cl)Cl
InChIInChI=1S/C9H12Cl3NSi/c1-13(2)9(14(10,11)12)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyXAESWCCQFZOUFB-UHFFFAOYSA-N
MW268.65 g/mol
LogP3.48
Rot. Bonds3

About N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine

N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine (PubChem CID 12521902) has the molecular formula C9H12Cl3NSi and a molecular weight of 268.65 g/mol. Its IUPAC name is N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine
PubChem CID12521902
Molecular FormulaC9H12Cl3NSi
Molecular Weight268.65 g/mol
Exact Mass266.98
IUPAC NameN,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine
SMILESCN(C)C(c1ccccc1)[Si](Cl)(Cl)Cl
InChIInChI=1S/C9H12Cl3NSi/c1-13(2)9(14(10,11)12)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyXAESWCCQFZOUFB-UHFFFAOYSA-N
XLogP3.48
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.65
LogP ≤ 53.48
H-Bond Donors ≤ 50
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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Related Compounds

(1S)-N,N-dimethyl-1-phenylethanamine
CID 2724276
(2S)-2-chloro-N-[(2S)-2-chloro-2-phenylethyl]-N-methyl-2-phenylethanamine
CID 97292301
trichloro-[(1S)-2-deuterio-1-phenylethyl]silane
CID 10752581
(1S)-N,N-dimethyl-1-phenylethanamine;hydrochloride
CID 141121906
lutetium;1-phenylethylphosphane
CID 87744905
N'-[2-(dimethylamino)-1,2-diphenylethyl]-N,N,N'-trimethyl-1,2-diphenylethane-1,2-diamine
CID 67414377
1-[2-[dimethylamino(phenyl)methyl]phenyl]-N,N-dimethyl-1-phenylmethanamine
CID 139888809
trichloro(1-phenylbut-2-enyl)silane
CID 139646025
(1S)-3-chloro-N,N-dimethyl-1-phenylpropan-1-amine
CID 141341786
N-methyl-1-phenyl-N-(trimethylsilylmethyl)ethanamine
CID 15113036
(1S)-N-methyl-1-phenyl-N-(trimethylsilylmethyl)ethanamine
CID 141001735
1-phenyl-N-trichlorosilyl-N-trimethylsilylethanamine
CID 71360479

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine?
The IUPAC name of N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine (CID 12521902) is N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine.
What is the SMILES notation for N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine?
The canonical SMILES for N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine is CN(C)C(c1ccccc1)[Si](Cl)(Cl)Cl.
What is the InChIKey of N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine?
The InChIKey is XAESWCCQFZOUFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12Cl3NSi/c1-13(2)9(14(10,11)12)8-6-4-3-5-7-8/h3-7,9H,1-2H3.
What are the key properties of N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine?
N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine has a molecular weight of 268.65 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-phenyl-1-trichlorosilylmethanamine is sourced from PubChem (CID 12521902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).