2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine

C19H23N — CID 62718277

IUPAC2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine
SMILESCc1cc(C)c(C2CCNC2c2ccccc2)c(C)c1
InChIInChI=1S/C19H23N/c1-13-11-14(2)18(15(3)12-13)17-9-10-20-19(17)16-7-5-4-6-8-16/h4-8,11-12,17,19-20H,9-10H2,1-3H3
InChIKeyMPAJECFBCGRTFA-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.43
Rot. Bonds2

About 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine

2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine (PubChem CID 62718277) has the molecular formula C19H23N and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine.

Molecular Properties

Compound Name2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine
PubChem CID62718277
Molecular FormulaC19H23N
Molecular Weight265.40 g/mol
Exact Mass265.18
IUPAC Name2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine
SMILESCc1cc(C)c(C2CCNC2c2ccccc2)c(C)c1
InChIInChI=1S/C19H23N/c1-13-11-14(2)18(15(3)12-13)17-9-10-20-19(17)16-7-5-4-6-8-16/h4-8,11-12,17,19-20H,9-10H2,1-3H3
InChIKeyMPAJECFBCGRTFA-UHFFFAOYSA-N
XLogP4.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine?
The IUPAC name of 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine (CID 62718277) is 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine.
What is the SMILES notation for 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine?
The canonical SMILES for 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine is Cc1cc(C)c(C2CCNC2c2ccccc2)c(C)c1.
What is the InChIKey of 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine?
The InChIKey is MPAJECFBCGRTFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N/c1-13-11-14(2)18(15(3)12-13)17-9-10-20-19(17)16-7-5-4-6-8-16/h4-8,11-12,17,19-20H,9-10H2,1-3H3.
What are the key properties of 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine?
2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine has a molecular weight of 265.40 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine is sourced from PubChem (CID 62718277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).