2-ethyl-4,4-diphenylpyrrolidine

C18H21N — CID 75282882

IUPAC2-ethyl-4,4-diphenylpyrrolidine
SMILESCCC1CC(c2ccccc2)(c2ccccc2)CN1
InChIInChI=1S/C18H21N/c1-2-17-13-18(14-19-17,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,2,13-14H2,1H3
InChIKeyICQAMIUZDYSOEL-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.74
Rot. Bonds3

About 2-ethyl-4,4-diphenylpyrrolidine

2-ethyl-4,4-diphenylpyrrolidine (PubChem CID 75282882) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-ethyl-4,4-diphenylpyrrolidine.

Molecular Properties

Compound Name2-ethyl-4,4-diphenylpyrrolidine
PubChem CID75282882
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name2-ethyl-4,4-diphenylpyrrolidine
SMILESCCC1CC(c2ccccc2)(c2ccccc2)CN1
InChIInChI=1S/C18H21N/c1-2-17-13-18(14-19-17,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,2,13-14H2,1H3
InChIKeyICQAMIUZDYSOEL-UHFFFAOYSA-N
XLogP3.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,4-diphenylpyrrolidine?
The IUPAC name of 2-ethyl-4,4-diphenylpyrrolidine (CID 75282882) is 2-ethyl-4,4-diphenylpyrrolidine.
What is the SMILES notation for 2-ethyl-4,4-diphenylpyrrolidine?
The canonical SMILES for 2-ethyl-4,4-diphenylpyrrolidine is CCC1CC(c2ccccc2)(c2ccccc2)CN1.
What is the InChIKey of 2-ethyl-4,4-diphenylpyrrolidine?
The InChIKey is ICQAMIUZDYSOEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-2-17-13-18(14-19-17,15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,2,13-14H2,1H3.
What are the key properties of 2-ethyl-4,4-diphenylpyrrolidine?
2-ethyl-4,4-diphenylpyrrolidine has a molecular weight of 251.37 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,4-diphenylpyrrolidine is sourced from PubChem (CID 75282882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).