2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine

C15H23N — CID 62352613

IUPAC2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine
SMILESCCc1ccc(C2(C)CCNC2CC)cc1
InChIInChI=1S/C15H23N/c1-4-12-6-8-13(9-7-12)15(3)10-11-16-14(15)5-2/h6-9,14,16H,4-5,10-11H2,1-3H3
InChIKeySPDDQWZBWLCIAM-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.28
Rot. Bonds3

About 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine

2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine (PubChem CID 62352613) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine.

Molecular Properties

Compound Name2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine
PubChem CID62352613
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine
SMILESCCc1ccc(C2(C)CCNC2CC)cc1
InChIInChI=1S/C15H23N/c1-4-12-6-8-13(9-7-12)15(3)10-11-16-14(15)5-2/h6-9,14,16H,4-5,10-11H2,1-3H3
InChIKeySPDDQWZBWLCIAM-UHFFFAOYSA-N
XLogP3.28
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-3-methyl-3-(4-propylphenyl)pyrrolidine
CID 55191908
3-(4-ethoxyphenyl)-2-ethyl-3-methylpyrrolidine
CID 62352999
2-ethyl-3-(5-ethylthiophen-2-yl)-3-methylpyrrolidine
CID 62355189
(3-methyl-3-pyridin-4-ylpyrrolidin-2-yl)methanol
CID 126982374
4-[3-methyl-2-(2-methylpropyl)pyrrolidin-3-yl]pyridine
CID 62753369
2-ethyl-3,3-dimethylpyrrolidine
CID 62352617
2-(4-ethylphenyl)-2-methylaziridine
CID 82467898
1-(1,4-dimethylcyclohexyl)-4-ethylbenzene
CID 71423616
4-(4-ethylphenyl)-4-methyl-5-(2-methylpropyl)pyrrolidin-2-one
CID 66108959
2-cyclopropyl-2-(4-ethylphenyl)azepane
CID 79119281
2-ethyl-2-(4-ethylphenyl)pyrrolidine
CID 66467145
3-(4-tert-butylphenyl)-2,3-dimethylpyrrolidine
CID 55062999

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine?
The IUPAC name of 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine (CID 62352613) is 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine.
What is the SMILES notation for 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine?
The canonical SMILES for 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine is CCc1ccc(C2(C)CCNC2CC)cc1.
What is the InChIKey of 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine?
The InChIKey is SPDDQWZBWLCIAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-4-12-6-8-13(9-7-12)15(3)10-11-16-14(15)5-2/h6-9,14,16H,4-5,10-11H2,1-3H3.
What are the key properties of 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine?
2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine has a molecular weight of 217.36 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(4-ethylphenyl)-3-methylpyrrolidine is sourced from PubChem (CID 62352613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).