1-phenyl-2-(2-phenylethyl)pyrrolidine

C18H21N — CID 10922989

IUPAC1-phenyl-2-(2-phenylethyl)pyrrolidine
SMILESc1ccc(CCC2CCCN2c2ccccc2)cc1
InChIInChI=1S/C18H21N/c1-3-8-16(9-4-1)13-14-18-12-7-15-19(18)17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2
InChIKeyMRLIAEATBLMQIF-UHFFFAOYSA-N
MW251.37 g/mol
LogP4.29
Rot. Bonds4

About 1-phenyl-2-(2-phenylethyl)pyrrolidine

1-phenyl-2-(2-phenylethyl)pyrrolidine (PubChem CID 10922989) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-phenyl-2-(2-phenylethyl)pyrrolidine.

Molecular Properties

Compound Name1-phenyl-2-(2-phenylethyl)pyrrolidine
PubChem CID10922989
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC Name1-phenyl-2-(2-phenylethyl)pyrrolidine
SMILESc1ccc(CCC2CCCN2c2ccccc2)cc1
InChIInChI=1S/C18H21N/c1-3-8-16(9-4-1)13-14-18-12-7-15-19(18)17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2
InChIKeyMRLIAEATBLMQIF-UHFFFAOYSA-N
XLogP4.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(2-phenylethyl)pyrrolidine?
The IUPAC name of 1-phenyl-2-(2-phenylethyl)pyrrolidine (CID 10922989) is 1-phenyl-2-(2-phenylethyl)pyrrolidine.
What is the SMILES notation for 1-phenyl-2-(2-phenylethyl)pyrrolidine?
The canonical SMILES for 1-phenyl-2-(2-phenylethyl)pyrrolidine is c1ccc(CCC2CCCN2c2ccccc2)cc1.
What is the InChIKey of 1-phenyl-2-(2-phenylethyl)pyrrolidine?
The InChIKey is MRLIAEATBLMQIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-3-8-16(9-4-1)13-14-18-12-7-15-19(18)17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2.
What are the key properties of 1-phenyl-2-(2-phenylethyl)pyrrolidine?
1-phenyl-2-(2-phenylethyl)pyrrolidine has a molecular weight of 251.37 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(2-phenylethyl)pyrrolidine is sourced from PubChem (CID 10922989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).