N,N-dimethyl-1,1,1-triphenylmethanamine

C21H21N — CID 3657291

IUPACN,N-dimethyl-1,1,1-triphenylmethanamine
SMILESCN(C)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N/c1-22(2)21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3
InChIKeyCJTMNDMKZBYLNA-UHFFFAOYSA-N
MW287.41 g/mol
LogP4.54
Rot. Bonds4

About N,N-dimethyl-1,1,1-triphenylmethanamine

N,N-dimethyl-1,1,1-triphenylmethanamine (PubChem CID 3657291) has the molecular formula C21H21N and a molecular weight of 287.41 g/mol. Its IUPAC name is N,N-dimethyl-1,1,1-triphenylmethanamine.

Molecular Properties

Compound NameN,N-dimethyl-1,1,1-triphenylmethanamine
PubChem CID3657291
Molecular FormulaC21H21N
Molecular Weight287.41 g/mol
Exact Mass287.17
IUPAC NameN,N-dimethyl-1,1,1-triphenylmethanamine
SMILESCN(C)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N/c1-22(2)21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3
InChIKeyCJTMNDMKZBYLNA-UHFFFAOYSA-N
XLogP4.54
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 54.54
H-Bond Donors ≤ 50
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,N-dimethyl-1,1,1-triphenylmethanamine?
The IUPAC name of N,N-dimethyl-1,1,1-triphenylmethanamine (CID 3657291) is N,N-dimethyl-1,1,1-triphenylmethanamine.
What is the SMILES notation for N,N-dimethyl-1,1,1-triphenylmethanamine?
The canonical SMILES for N,N-dimethyl-1,1,1-triphenylmethanamine is CN(C)C(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N-dimethyl-1,1,1-triphenylmethanamine?
The InChIKey is CJTMNDMKZBYLNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N/c1-22(2)21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17H,1-2H3.
What are the key properties of N,N-dimethyl-1,1,1-triphenylmethanamine?
N,N-dimethyl-1,1,1-triphenylmethanamine has a molecular weight of 287.41 g/mol, XLogP of 4.54, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1,1,1-triphenylmethanamine is sourced from PubChem (CID 3657291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).