2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine

C11H23NO — CID 176568736

IUPAC2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
SMILESCCC1(COC(C)C)CCCN1C
InChIInChI=1S/C11H23NO/c1-5-11(9-13-10(2)3)7-6-8-12(11)4/h10H,5-9H2,1-4H3
InChIKeyYFCVDAWUYRZZJL-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.29
Rot. Bonds4

About 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine

2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine (PubChem CID 176568736) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine.

Molecular Properties

Compound Name2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
PubChem CID176568736
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
SMILESCCC1(COC(C)C)CCCN1C
InChIInChI=1S/C11H23NO/c1-5-11(9-13-10(2)3)7-6-8-12(11)4/h10H,5-9H2,1-4H3
InChIKeyYFCVDAWUYRZZJL-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(methoxymethyl)-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 176568360
[1-methyl-2-(propan-2-yloxymethyl)pyrrolidin-2-yl]methanol
CID 169202555
2-ethyl-2-(methoxymethyl)-1-methylpyrrolidine
CID 118615709
ethane;(2-ethyl-1-methylpyrrolidin-2-yl)methanol
CID 170726282
[1-methyl-2-(undecan-4-yloxymethyl)pyrrolidin-2-yl]methanol
CID 175617410
1-ethyl-1-(propan-2-yloxymethyl)cyclopropane
CID 157344699
(3S)-3-fluoro-1-methyl-3-(propan-2-yloxymethyl)piperidine
CID 147142299
1,1-bis(propan-2-yloxymethyl)cyclobutane
CID 141062345
2-methyl-1-(propan-2-yloxymethyl)-2-azabicyclo[3.2.0]heptane
CID 177126114
1-methyl-4-methylidene-2-(propan-2-yloxymethyl)-2-propylpyrrolidine
CID 176921046
1-(3-fluoropropyl)-2-methyl-2-(propan-2-yloxymethyl)pyrrolidine
CID 163889613
1-(chloromethyl)-1-(propan-2-yloxymethyl)cyclopentane
CID 165446225

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine?
The IUPAC name of 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine (CID 176568736) is 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine.
What is the SMILES notation for 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine?
The canonical SMILES for 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine is CCC1(COC(C)C)CCCN1C.
What is the InChIKey of 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine?
The InChIKey is YFCVDAWUYRZZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-5-11(9-13-10(2)3)7-6-8-12(11)4/h10H,5-9H2,1-4H3.
What are the key properties of 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine?
2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine has a molecular weight of 185.31 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-methyl-2-(propan-2-yloxymethyl)pyrrolidine is sourced from PubChem (CID 176568736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).