2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine

C15H23N — CID 117271535

IUPAC2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine
SMILESCCC1(CCc2ccc(C)cc2)CCCN1
InChIInChI=1S/C15H23N/c1-3-15(10-4-12-16-15)11-9-14-7-5-13(2)6-8-14/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeyJUSGAHPEGNNAOU-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.46
Rot. Bonds4

About 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine

2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine (PubChem CID 117271535) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine.

Molecular Properties

Compound Name2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine
PubChem CID117271535
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine
SMILESCCC1(CCc2ccc(C)cc2)CCCN1
InChIInChI=1S/C15H23N/c1-3-15(10-4-12-16-15)11-9-14-7-5-13(2)6-8-14/h5-8,16H,3-4,9-12H2,1-2H3
InChIKeyJUSGAHPEGNNAOU-UHFFFAOYSA-N
XLogP3.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(4-bromophenyl)ethyl]-2-ethylpiperidine
CID 117271757
2-ethyl-2-[(4-methylphenyl)methyl]piperidine
CID 115058967
2-ethyl-2-[2-[4-(trifluoromethyl)phenyl]ethyl]piperidine
CID 117271747
2-ethyl-2-[2-(3-fluorophenyl)ethyl]pyrrolidine
CID 117271498
2-[(4-methylphenyl)methyl]-2-propylpiperidine
CID 115058989
2-ethyl-2-(2-thiophen-2-ylethyl)pyrrolidine
CID 66467603
2-ethyl-2-(2-thiophen-2-ylethyl)piperidine
CID 117271805
2-[(2-ethylpyrrolidin-2-yl)methyl]-5-methylpyridine
CID 104688305
2-[(3-bromo-4-methylphenyl)methyl]-2-ethylpyrrolidine
CID 105411973
2-[(3-chloro-4-methylphenyl)methyl]-2-ethylpyrrolidine
CID 106819392
1-methyl-4-[2-(2-propylpyrrolidin-2-yl)ethyl]pyrazole
CID 103010970
2-(3-phenylpropyl)-2-propylpyrrolidine
CID 66467164

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine?
The IUPAC name of 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine (CID 117271535) is 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine.
What is the SMILES notation for 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine?
The canonical SMILES for 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine is CCC1(CCc2ccc(C)cc2)CCCN1.
What is the InChIKey of 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine?
The InChIKey is JUSGAHPEGNNAOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-15(10-4-12-16-15)11-9-14-7-5-13(2)6-8-14/h5-8,16H,3-4,9-12H2,1-2H3.
What are the key properties of 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine?
2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine has a molecular weight of 217.36 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[2-(4-methylphenyl)ethyl]pyrrolidine is sourced from PubChem (CID 117271535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).