1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine

C13H26N2O — CID 104746984

IUPAC1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine
SMILESCC(C)C1CCN(CC(N)C2CCOC2)C1
InChIInChI=1S/C13H26N2O/c1-10(2)11-3-5-15(7-11)8-13(14)12-4-6-16-9-12/h10-13H,3-9,14H2,1-2H3
InChIKeyLAHFELGQNCPLFB-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.33
Rot. Bonds4

About 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine

1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine (PubChem CID 104746984) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine.

Molecular Properties

Compound Name1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine
PubChem CID104746984
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine
SMILESCC(C)C1CCN(CC(N)C2CCOC2)C1
InChIInChI=1S/C13H26N2O/c1-10(2)11-3-5-15(7-11)8-13(14)12-4-6-16-9-12/h10-13H,3-9,14H2,1-2H3
InChIKeyLAHFELGQNCPLFB-UHFFFAOYSA-N
XLogP1.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-1-(oxolan-3-yl)ethanamine
CID 113448316
2-(2-ethylmorpholin-4-yl)-1-(oxolan-3-yl)ethanamine
CID 104744806
3-[(3-propan-2-ylpyrrolidin-1-yl)methyl]oxan-4-amine
CID 103060817
1-(oxolan-3-yl)butan-1-amine
CID 63564938
1-(oxolan-3-yl)butan-1-amine;hydrate
CID 174673469
N-methyl-1-(oxolan-3-yl)-2-(4-propan-2-ylazepan-1-yl)ethanamine
CID 104746479
N',N'-bis(3-methylbutyl)-1-(oxolan-3-yl)ethane-1,2-diamine
CID 107869656
1-[1-[2-(oxolan-3-yl)ethyl]pyrrolidin-3-yl]ethanamine;hydrochloride
CID 120843380
1-(oxolan-3-yl)-2-pyrazol-1-ylethanamine
CID 104747073
(1R)-1-[(3S)-oxolan-3-yl]ethanamine
CID 95396571
2-(4-methyl-2,3-dihydroquinoxalin-1-yl)-1-(oxolan-3-yl)ethanamine
CID 104746378
1-[2-amino-2-(oxolan-3-yl)ethyl]-4-propylpiperazine-2,5-dione
CID 104747986

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine?
The IUPAC name of 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine (CID 104746984) is 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine.
What is the SMILES notation for 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine?
The canonical SMILES for 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine is CC(C)C1CCN(CC(N)C2CCOC2)C1.
What is the InChIKey of 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine?
The InChIKey is LAHFELGQNCPLFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-10(2)11-3-5-15(7-11)8-13(14)12-4-6-16-9-12/h10-13H,3-9,14H2,1-2H3.
What are the key properties of 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine?
1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine has a molecular weight of 226.36 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)-2-(3-propan-2-ylpyrrolidin-1-yl)ethanamine is sourced from PubChem (CID 104746984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).