1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine

C24H24ClN — CID 16723405

IUPAC1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine
SMILESCC1CC(c2ccccc2)(c2ccccc2)CN1Cc1ccc(Cl)cc1
InChIInChI=1S/C24H24ClN/c1-19-16-24(21-8-4-2-5-9-21,22-10-6-3-7-11-22)18-26(19)17-20-12-14-23(25)15-13-20/h2-15,19H,16-18H2,1H3
InChIKeyOLNMXYSWIWTYLZ-UHFFFAOYSA-N
MW361.92 g/mol
LogP5.92
Rot. Bonds4

About 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine

1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine (PubChem CID 16723405) has the molecular formula C24H24ClN and a molecular weight of 361.92 g/mol. Its IUPAC name is 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine.

Molecular Properties

Compound Name1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine
PubChem CID16723405
Molecular FormulaC24H24ClN
Molecular Weight361.92 g/mol
Exact Mass361.16
IUPAC Name1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine
SMILESCC1CC(c2ccccc2)(c2ccccc2)CN1Cc1ccc(Cl)cc1
InChIInChI=1S/C24H24ClN/c1-19-16-24(21-8-4-2-5-9-21,22-10-6-3-7-11-22)18-26(19)17-20-12-14-23(25)15-13-20/h2-15,19H,16-18H2,1H3
InChIKeyOLNMXYSWIWTYLZ-UHFFFAOYSA-N
XLogP5.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.92
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine?
The IUPAC name of 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine (CID 16723405) is 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine.
What is the SMILES notation for 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine?
The canonical SMILES for 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine is CC1CC(c2ccccc2)(c2ccccc2)CN1Cc1ccc(Cl)cc1.
What is the InChIKey of 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine?
The InChIKey is OLNMXYSWIWTYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN/c1-19-16-24(21-8-4-2-5-9-21,22-10-6-3-7-11-22)18-26(19)17-20-12-14-23(25)15-13-20/h2-15,19H,16-18H2,1H3.
What are the key properties of 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine?
1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine has a molecular weight of 361.92 g/mol, XLogP of 5.92, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-chlorophenyl)methyl]-2-methyl-4,4-diphenylpyrrolidine is sourced from PubChem (CID 16723405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).