2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine

C15H32N2O2 — CID 82953975

IUPAC2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine
SMILESCCOCCN(CCOCC)CC1(CC)CCNC1
InChIInChI=1S/C15H32N2O2/c1-4-15(7-8-16-13-15)14-17(9-11-18-5-2)10-12-19-6-3/h16H,4-14H2,1-3H3
InChIKeyHUWUOHBNTLIEPZ-UHFFFAOYSA-N
MW272.43 g/mol
LogP1.75
Rot. Bonds11

About 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine

2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine (PubChem CID 82953975) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine
PubChem CID82953975
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC Name2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine
SMILESCCOCCN(CCOCC)CC1(CC)CCNC1
InChIInChI=1S/C15H32N2O2/c1-4-15(7-8-16-13-15)14-17(9-11-18-5-2)10-12-19-6-3/h16H,4-14H2,1-3H3
InChIKeyHUWUOHBNTLIEPZ-UHFFFAOYSA-N
XLogP1.75
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(3-ethylpiperidin-3-yl)methyl]-2-methoxy-N-(2-methoxyethyl)ethanamine
CID 63133024
N-[[1-(aminomethyl)cyclopropyl]methyl]-2-ethoxy-N-(2-ethoxyethyl)ethanamine
CID 82954753
N-[(3-ethylpiperidin-3-yl)methyl]-N-propylpropan-1-amine
CID 63133368
[1-[[bis(2-ethoxyethyl)amino]methyl]cycloheptyl]methanol
CID 82941164
N-[(4-ethylpiperidin-4-yl)methyl]-N-propylpropan-1-amine
CID 63129554
3-(2-ethoxyethyl)-3-ethylazetidine
CID 79451036
N-[(3-ethylpyrrolidin-3-yl)methyl]-N,2-dimethylbutan-2-amine
CID 63957661
N-(2-ethoxyethyl)-N,3-diethylpyrrolidine-3-carboxamide
CID 63692883
N,N-bis(2-ethoxyethyl)-4-ethylpiperidine-4-carboxamide
CID 82960199
1-[[2-ethoxyethyl(ethyl)amino]methyl]cyclopentane-1-carbaldehyde
CID 63692113
N-[(3-ethylpyrrolidin-3-yl)methyl]-N,2-dimethylbutan-1-amine
CID 63143220
N-[[1-[[2-ethoxyethyl(ethyl)amino]methyl]cyclohexyl]methyl]propan-2-amine
CID 63692839

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine?
The IUPAC name of 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine (CID 82953975) is 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine.
What is the SMILES notation for 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine?
The canonical SMILES for 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine is CCOCCN(CCOCC)CC1(CC)CCNC1.
What is the InChIKey of 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine?
The InChIKey is HUWUOHBNTLIEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-4-15(7-8-16-13-15)14-17(9-11-18-5-2)10-12-19-6-3/h16H,4-14H2,1-3H3.
What are the key properties of 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine?
2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine has a molecular weight of 272.43 g/mol, XLogP of 1.75, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2-ethoxyethyl)-N-[(3-ethylpyrrolidin-3-yl)methyl]ethanamine is sourced from PubChem (CID 82953975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).