2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine

C10H22N2O — CID 166870516

IUPAC2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine
SMILESCC1[C@H](OCCN(C)C)CCN1C
InChIInChI=1S/C10H22N2O/c1-9-10(5-6-12(9)4)13-8-7-11(2)3/h9-10H,5-8H2,1-4H3/t9?,10-/m1/s1
InChIKeyLASQUWCENAZRJS-QVDQXJPCSA-N
MW186.30 g/mol
LogP0.66
Rot. Bonds4

About 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine

2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine (PubChem CID 166870516) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine
PubChem CID166870516
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine
SMILESCC1[C@H](OCCN(C)C)CCN1C
InChIInChI=1S/C10H22N2O/c1-9-10(5-6-12(9)4)13-8-7-11(2)3/h9-10H,5-8H2,1-4H3/t9?,10-/m1/s1
InChIKeyLASQUWCENAZRJS-QVDQXJPCSA-N
XLogP0.66
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4S)-1,2-dimethyl-4-(2,2,2-trifluoroethoxy)pyrrolidine
CID 89595711
(2R,4S)-1,2-dimethyl-4-(2,2,2-trifluoroethoxy)pyrrolidine
CID 89887889
(2R)-4-(2,2-difluoroethoxy)-1,2-dimethylpyrrolidine
CID 89945475
(2R)-1,2-dimethyl-4-(2,2,2-trifluoroethoxy)pyrrolidine
CID 89945562
4-Fluoro-3-methoxy-2-methyl-1-propan-2-ylpyrrolidine
CID 145325773
(2R,3R,4R)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153298351
(2R,3S,4S)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153298377
2-[(2R,3S,4S)-1-tert-butyl-4-fluoro-2-methylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine
CID 153298786
(2R,3R,4S)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153298911
(2R,3S,4R)-1-tert-butyl-4-fluoro-3-methoxy-2-methylpyrrolidine
CID 153306742
3-(2-Fluoroethoxy)-1-propan-2-ylpyrrolidine
CID 155452437
3-(Fluoromethoxy)-1-propan-2-ylpyrrolidine
CID 155640506

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine?
The IUPAC name of 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine (CID 166870516) is 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine.
What is the SMILES notation for 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine?
The canonical SMILES for 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine is CC1[C@H](OCCN(C)C)CCN1C.
What is the InChIKey of 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine?
The InChIKey is LASQUWCENAZRJS-QVDQXJPCSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9-10(5-6-12(9)4)13-8-7-11(2)3/h9-10H,5-8H2,1-4H3/t9?,10-/m1/s1.
What are the key properties of 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine?
2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine has a molecular weight of 186.30 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-1,2-dimethylpyrrolidin-3-yl]oxy-N,N-dimethylethanamine is sourced from PubChem (CID 166870516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).