1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine

C22H23NO — CID 70682683

IUPAC1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine
SMILESCOc1ccc(C(c2ccccc2)(c2ccccc2)N(C)C)cc1
InChIInChI=1S/C22H23NO/c1-23(2)22(18-10-6-4-7-11-18,19-12-8-5-9-13-19)20-14-16-21(24-3)17-15-20/h4-17H,1-3H3
InChIKeyGBSKVROJXNNMFE-UHFFFAOYSA-N
MW317.43 g/mol
LogP4.55
Rot. Bonds5

About 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine

1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine (PubChem CID 70682683) has the molecular formula C22H23NO and a molecular weight of 317.43 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine
PubChem CID70682683
Molecular FormulaC22H23NO
Molecular Weight317.43 g/mol
Exact Mass317.18
IUPAC Name1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine
SMILESCOc1ccc(C(c2ccccc2)(c2ccccc2)N(C)C)cc1
InChIInChI=1S/C22H23NO/c1-23(2)22(18-10-6-4-7-11-18,19-12-8-5-9-13-19)20-14-16-21(24-3)17-15-20/h4-17H,1-3H3
InChIKeyGBSKVROJXNNMFE-UHFFFAOYSA-N
XLogP4.55
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine?
The IUPAC name of 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine (CID 70682683) is 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine?
The canonical SMILES for 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine is COc1ccc(C(c2ccccc2)(c2ccccc2)N(C)C)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine?
The InChIKey is GBSKVROJXNNMFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO/c1-23(2)22(18-10-6-4-7-11-18,19-12-8-5-9-13-19)20-14-16-21(24-3)17-15-20/h4-17H,1-3H3.
What are the key properties of 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine?
1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine has a molecular weight of 317.43 g/mol, XLogP of 4.55, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N,N-dimethyl-1,1-diphenylmethanamine is sourced from PubChem (CID 70682683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).