2-ethoxy-2-ethylpyrrolidine

C8H17NO — CID 69498113

IUPAC2-ethoxy-2-ethylpyrrolidine
SMILESCCOC1(CC)CCCN1
InChIInChI=1S/C8H17NO/c1-3-8(10-4-2)6-5-7-9-8/h9H,3-7H2,1-2H3
InChIKeyJDZLEGAQDDWHRM-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.51
Rot. Bonds3

About 2-ethoxy-2-ethylpyrrolidine

2-ethoxy-2-ethylpyrrolidine (PubChem CID 69498113) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-ethoxy-2-ethylpyrrolidine.

Molecular Properties

Compound Name2-ethoxy-2-ethylpyrrolidine
PubChem CID69498113
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2-ethoxy-2-ethylpyrrolidine
SMILESCCOC1(CC)CCCN1
InChIInChI=1S/C8H17NO/c1-3-8(10-4-2)6-5-7-9-8/h9H,3-7H2,1-2H3
InChIKeyJDZLEGAQDDWHRM-UHFFFAOYSA-N
XLogP1.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,3,3-tetraethylpiperidine
CID 173426898
4,4-diethoxy-2,2-dimethylpiperidine
CID 166543313
4-ethoxy-4-ethylpiperidine
CID 97036963
ethyl formate;8-oxa-1-azaspiro[4.5]decane
CID 161068190
2,2-diethyl-1,3-diazinane
CID 55286866
2-diethoxyphosphoryl-2-methylpyrrolidine
CID 5007980
ethyl (2S)-2-methylpyrrolidine-2-carboxylate
CID 45115906
2,2-dipropylpyrrolidine
CID 13332418
1,1,3,3-tetraethoxycyclohexane
CID 151917056
N-[(2-ethylpyrrolidin-2-yl)methyl]-2-methoxy-N-methylethanamine
CID 83073163
2-butoxy-2-methoxypyrrolidine
CID 68812660
cyclopentane;1-ethoxy-1-methylsulfanylcyclopentane
CID 67853175

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-ethylpyrrolidine?
The IUPAC name of 2-ethoxy-2-ethylpyrrolidine (CID 69498113) is 2-ethoxy-2-ethylpyrrolidine.
What is the SMILES notation for 2-ethoxy-2-ethylpyrrolidine?
The canonical SMILES for 2-ethoxy-2-ethylpyrrolidine is CCOC1(CC)CCCN1.
What is the InChIKey of 2-ethoxy-2-ethylpyrrolidine?
The InChIKey is JDZLEGAQDDWHRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-8(10-4-2)6-5-7-9-8/h9H,3-7H2,1-2H3.
What are the key properties of 2-ethoxy-2-ethylpyrrolidine?
2-ethoxy-2-ethylpyrrolidine has a molecular weight of 143.23 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-ethylpyrrolidine is sourced from PubChem (CID 69498113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).