2-ethyl-1,3,3,4,5-pentamethylpyrrolidine

C11H23N — CID 123259203

IUPAC2-ethyl-1,3,3,4,5-pentamethylpyrrolidine
SMILESCCC1N(C)C(C)C(C)C1(C)C
InChIInChI=1S/C11H23N/c1-7-10-11(4,5)8(2)9(3)12(10)6/h8-10H,7H2,1-6H3
InChIKeyPHXLVQNQPDKMGI-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.76
Rot. Bonds1

About 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine

2-ethyl-1,3,3,4,5-pentamethylpyrrolidine (PubChem CID 123259203) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine.

Molecular Properties

Compound Name2-ethyl-1,3,3,4,5-pentamethylpyrrolidine
PubChem CID123259203
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name2-ethyl-1,3,3,4,5-pentamethylpyrrolidine
SMILESCCC1N(C)C(C)C(C)C1(C)C
InChIInChI=1S/C11H23N/c1-7-10-11(4,5)8(2)9(3)12(10)6/h8-10H,7H2,1-6H3
InChIKeyPHXLVQNQPDKMGI-UHFFFAOYSA-N
XLogP2.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-1,2,3-trimethylaziridine
CID 154470039
(2R)-2-ethyl-3,3-difluoro-1-methylpyrrolidine
CID 171827247
2-(2-ethyl-1-methylcyclopropyl)-1,1,3-trimethylcyclopropane
CID 123601858
2-ethyl-1,1,4-trimethylcyclobutane
CID 91404893
2,6-diethyl-1,4,4,8,8,10-hexamethylazecane
CID 123697519
1,2,3,4,5,6,7,8,9,10,11,12-dodecamethyl-1,4,7,10-tetrazacyclododecane
CID 58816940
1,3,4,4,5-pentamethylpiperidine
CID 18740724
ethane;propane;1,1,3-trimethylcyclobutane
CID 166460974
2,4-diethyl-1,1-dimethylcyclobutane;methane
CID 156895183
3-ethyl-1,1,2-trimethylcyclopentane
CID 123564312
2-ethyl-1,3,4-trimethylimidazolidine
CID 66739096
4-tert-butyl-1,2,3,4-tetramethylpyrrolidine
CID 159542995

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine?
The IUPAC name of 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine (CID 123259203) is 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine.
What is the SMILES notation for 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine?
The canonical SMILES for 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine is CCC1N(C)C(C)C(C)C1(C)C.
What is the InChIKey of 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine?
The InChIKey is PHXLVQNQPDKMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-7-10-11(4,5)8(2)9(3)12(10)6/h8-10H,7H2,1-6H3.
What are the key properties of 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine?
2-ethyl-1,3,3,4,5-pentamethylpyrrolidine has a molecular weight of 169.31 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,3,3,4,5-pentamethylpyrrolidine is sourced from PubChem (CID 123259203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).