1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine

C13H23Cl2NSi2 — CID 175408687

IUPAC1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine
SMILESC[Si](C)(C)N(C(Cl)(Cl)c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C13H23Cl2NSi2/c1-17(2,3)16(18(4,5)6)13(14,15)12-10-8-7-9-11-12/h7-11H,1-6H3
InChIKeyNXYVNCMNEDUGSO-UHFFFAOYSA-N
MW320.41 g/mol
LogP5.25
Rot. Bonds4

About 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine

1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine (PubChem CID 175408687) has the molecular formula C13H23Cl2NSi2 and a molecular weight of 320.41 g/mol. Its IUPAC name is 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine.

Molecular Properties

Compound Name1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine
PubChem CID175408687
Molecular FormulaC13H23Cl2NSi2
Molecular Weight320.41 g/mol
Exact Mass319.07
IUPAC Name1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine
SMILESC[Si](C)(C)N(C(Cl)(Cl)c1ccccc1)[Si](C)(C)C
InChIInChI=1S/C13H23Cl2NSi2/c1-17(2,3)16(18(4,5)6)13(14,15)12-10-8-7-9-11-12/h7-11H,1-6H3
InChIKeyNXYVNCMNEDUGSO-UHFFFAOYSA-N
XLogP5.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.41
LogP ≤ 55.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine?
The IUPAC name of 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine (CID 175408687) is 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine.
What is the SMILES notation for 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine?
The canonical SMILES for 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine is C[Si](C)(C)N(C(Cl)(Cl)c1ccccc1)[Si](C)(C)C.
What is the InChIKey of 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine?
The InChIKey is NXYVNCMNEDUGSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23Cl2NSi2/c1-17(2,3)16(18(4,5)6)13(14,15)12-10-8-7-9-11-12/h7-11H,1-6H3.
What are the key properties of 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine?
1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine has a molecular weight of 320.41 g/mol, XLogP of 5.25, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dichloro-1-phenyl-N,N-bis(trimethylsilyl)methanamine is sourced from PubChem (CID 175408687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).