N-benzyl-1,1,1-triphenylmethanamine

C26H23N — CID 623373

IUPACN-benzyl-1,1,1-triphenylmethanamine
SMILESc1ccc(CNC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H23N/c1-5-13-22(14-6-1)21-27-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20,27H,21H2
InChIKeyKHCIKYIRXBURMY-UHFFFAOYSA-N
MW349.48 g/mol
LogP5.77
Rot. Bonds6

About N-benzyl-1,1,1-triphenylmethanamine

N-benzyl-1,1,1-triphenylmethanamine (PubChem CID 623373) has the molecular formula C26H23N and a molecular weight of 349.48 g/mol. Its IUPAC name is N-benzyl-1,1,1-triphenylmethanamine.

Molecular Properties

Compound NameN-benzyl-1,1,1-triphenylmethanamine
PubChem CID623373
Molecular FormulaC26H23N
Molecular Weight349.48 g/mol
Exact Mass349.18
IUPAC NameN-benzyl-1,1,1-triphenylmethanamine
SMILESc1ccc(CNC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C26H23N/c1-5-13-22(14-6-1)21-27-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20,27H,21H2
InChIKeyKHCIKYIRXBURMY-UHFFFAOYSA-N
XLogP5.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.48
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-1,1,1-triphenylmethanamine?
The IUPAC name of N-benzyl-1,1,1-triphenylmethanamine (CID 623373) is N-benzyl-1,1,1-triphenylmethanamine.
What is the SMILES notation for N-benzyl-1,1,1-triphenylmethanamine?
The canonical SMILES for N-benzyl-1,1,1-triphenylmethanamine is c1ccc(CNC(c2ccccc2)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-benzyl-1,1,1-triphenylmethanamine?
The InChIKey is KHCIKYIRXBURMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N/c1-5-13-22(14-6-1)21-27-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-20,27H,21H2.
What are the key properties of N-benzyl-1,1,1-triphenylmethanamine?
N-benzyl-1,1,1-triphenylmethanamine has a molecular weight of 349.48 g/mol, XLogP of 5.77, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-1,1,1-triphenylmethanamine is sourced from PubChem (CID 623373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).