2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine

C12H26N2 — CID 170066692

IUPAC2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine
SMILESCCN1CCC(CC)(CCN(C)C)C1
InChIInChI=1S/C12H26N2/c1-5-12(7-9-13(3)4)8-10-14(6-2)11-12/h5-11H2,1-4H3
InChIKeyCYHUWLQSJLCBAG-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.06
Rot. Bonds5

About 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine

2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine (PubChem CID 170066692) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine
PubChem CID170066692
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine
SMILESCCN1CCC(CC)(CCN(C)C)C1
InChIInChI=1S/C12H26N2/c1-5-12(7-9-13(3)4)8-10-14(6-2)11-12/h5-11H2,1-4H3
InChIKeyCYHUWLQSJLCBAG-UHFFFAOYSA-N
XLogP2.06
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

potassium;2-[3-[2-(dimethylamino)ethyl]-3-ethylazetidin-1-yl]ethylazanide;ethane
CID 178034658
2-(1-ethylcyclohexyl)-N,N-dimethylethanamine
CID 143122027
2-(3-ethyloxetan-3-yl)-N,N-dimethylethanamine
CID 144841125
[3-(aminomethyl)-1-ethylpyrrolidin-3-yl]methanol
CID 15107452
N-[2-(1-tert-butyl-3-ethylpyrrolidin-3-yl)ethyl]-N-methylpropan-2-amine
CID 135224586
1-(3-ethyl-1-methylpyrrolidin-3-yl)-N,N-dimethylmethanamine
CID 129233925
1,3-diethylpyrrolidin-3-ol
CID 67586028
[1-[2-(dimethylamino)ethyl]cyclopropyl]methanol
CID 130950587
6-ethyl-1,2,6-triazaspiro[2.4]hept-1-ene
CID 121460088
10-[(1,3-diethylpyrrolidin-3-yl)methyl]phenothiazine
CID 10359800
1,3-diethyl-3-propan-2-ylpyrrolidine
CID 131976816
2-[(3,3-diethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
CID 104595182

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine (CID 170066692) is 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine is CCN1CCC(CC)(CCN(C)C)C1.
What is the InChIKey of 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine?
The InChIKey is CYHUWLQSJLCBAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-5-12(7-9-13(3)4)8-10-14(6-2)11-12/h5-11H2,1-4H3.
What are the key properties of 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine?
2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine has a molecular weight of 198.35 g/mol, XLogP of 2.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-diethylpyrrolidin-3-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 170066692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).