N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine

C21H23NSi — CID 173402235

IUPACN-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine
SMILESC[SiH](c1ccccc1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H23NSi/c1-23(21-15-9-4-10-16-21)22(17-19-11-5-2-6-12-19)18-20-13-7-3-8-14-20/h2-16,23H,17-18H2,1H3
InChIKeyPKCZILNEIDCWAC-UHFFFAOYSA-N
MW317.51 g/mol
LogP3.95
Rot. Bonds6

About N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine

N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine (PubChem CID 173402235) has the molecular formula C21H23NSi and a molecular weight of 317.51 g/mol. Its IUPAC name is N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine
PubChem CID173402235
Molecular FormulaC21H23NSi
Molecular Weight317.51 g/mol
Exact Mass317.16
IUPAC NameN-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine
SMILESC[SiH](c1ccccc1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C21H23NSi/c1-23(21-15-9-4-10-16-21)22(17-19-11-5-2-6-12-19)18-20-13-7-3-8-14-20/h2-16,23H,17-18H2,1H3
InChIKeyPKCZILNEIDCWAC-UHFFFAOYSA-N
XLogP3.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.51
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine?
The IUPAC name of N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine (CID 173402235) is N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine.
What is the SMILES notation for N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine?
The canonical SMILES for N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine is C[SiH](c1ccccc1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine?
The InChIKey is PKCZILNEIDCWAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NSi/c1-23(21-15-9-4-10-16-21)22(17-19-11-5-2-6-12-19)18-20-13-7-3-8-14-20/h2-16,23H,17-18H2,1H3.
What are the key properties of N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine?
N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine has a molecular weight of 317.51 g/mol, XLogP of 3.95, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-[methyl(phenyl)silyl]-1-phenylmethanamine is sourced from PubChem (CID 173402235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).