2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine

C14H28N2O — CID 82835130

IUPAC2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine
SMILESCCC1(CC)CCN(C(CN)C2CCCO2)C1
InChIInChI=1S/C14H28N2O/c1-3-14(4-2)7-8-16(11-14)12(10-15)13-6-5-9-17-13/h12-13H,3-11,15H2,1-2H3
InChIKeyPKGCHTGGYRFMDQ-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.00
Rot. Bonds5

About 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine

2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine (PubChem CID 82835130) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine
PubChem CID82835130
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine
SMILESCCC1(CC)CCN(C(CN)C2CCCO2)C1
InChIInChI=1S/C14H28N2O/c1-3-14(4-2)7-8-16(11-14)12(10-15)13-6-5-9-17-13/h12-13H,3-11,15H2,1-2H3
InChIKeyPKGCHTGGYRFMDQ-UHFFFAOYSA-N
XLogP2.00
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxolan-2-yl)-2-thiomorpholin-4-ylethanamine
CID 82836499
2-(oxolan-2-yl)-2-(2,2,6-trimethylmorpholin-4-yl)ethanamine
CID 82835815
2-(oxolan-2-yl)-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanamine
CID 82835820
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-(oxolan-2-yl)ethanamine
CID 82835938
2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(oxolan-2-yl)ethanamine
CID 82839506
2-(2,5-dimethylmorpholin-4-yl)-2-(oxolan-2-yl)ethanamine
CID 82836404
2-(3-methoxy-3-methylpiperidin-1-yl)-2-(5-methyloxolan-2-yl)ethanamine
CID 107391237
2-(4,4-dimethylazepan-1-yl)-2-(oxolan-3-yl)ethanamine
CID 65283837
2-cyclopentyl-2-(2,2-dimethylmorpholin-4-yl)ethanamine
CID 62070004
2-(4,4-diethylpiperidin-1-yl)-4-methylpentan-1-amine
CID 63156923
1-(oxolan-2-yl)-N-propan-2-ylethane-1,2-diamine
CID 82835407
[1-(4,4-diethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 63467046

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine?
The IUPAC name of 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine (CID 82835130) is 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine.
What is the SMILES notation for 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine?
The canonical SMILES for 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine is CCC1(CC)CCN(C(CN)C2CCCO2)C1.
What is the InChIKey of 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine?
The InChIKey is PKGCHTGGYRFMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-14(4-2)7-8-16(11-14)12(10-15)13-6-5-9-17-13/h12-13H,3-11,15H2,1-2H3.
What are the key properties of 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine?
2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine has a molecular weight of 240.39 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-diethylpyrrolidin-1-yl)-2-(oxolan-2-yl)ethanamine is sourced from PubChem (CID 82835130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).