N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine

C12H26N2O2 — CID 102657031

IUPACN-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
SMILESCOCCN(CCOC1(C)CNC1)C(C)C
InChIInChI=1S/C12H26N2O2/c1-11(2)14(5-7-15-4)6-8-16-12(3)9-13-10-12/h11,13H,5-10H2,1-4H3
InChIKeyDSMAGGRSDHUJHN-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.72
Rot. Bonds8

About N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine

N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine (PubChem CID 102657031) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
PubChem CID102657031
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
SMILESCOCCN(CCOC1(C)CNC1)C(C)C
InChIInChI=1S/C12H26N2O2/c1-11(2)14(5-7-15-4)6-8-16-12(3)9-13-10-12/h11,13H,5-10H2,1-4H3
InChIKeyDSMAGGRSDHUJHN-UHFFFAOYSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,2,2-trifluoro-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102656759
N-ethyl-2,2,2-trifluoro-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102656851
N-[2-(3-methylazetidin-3-yl)oxyethyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 102656854
N-[2-(3-methylazetidin-3-yl)oxyethyl]-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 102656855
3,3,3-trifluoro-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-1-amine
CID 102656974
2,2-difluoro-N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]ethanamine
CID 102657058
4,4,4-trifluoro-N-[2-(3-methylazetidin-3-yl)oxyethyl]butan-2-amine
CID 105946135
N-[2-(3-methylazetidin-3-yl)oxyethyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 113721346
4-(Azetidin-3-yl)-2,2-dimethylmorpholine
CID 62784795
3-[(2-Ethoxyethylamino)methyl]azetidin-3-ol
CID 69111634
1-{2-[(3-Methylazetidin-3-yl)oxy]ethyl}pyrrolidine
CID 83067109
2-Propan-2-yl-5-oxa-2,8-diazaspiro[3.5]nonane
CID 129223717

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
The IUPAC name of N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine (CID 102657031) is N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine.
What is the SMILES notation for N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
The canonical SMILES for N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine is COCCN(CCOC1(C)CNC1)C(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
The InChIKey is DSMAGGRSDHUJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-11(2)14(5-7-15-4)6-8-16-12(3)9-13-10-12/h11,13H,5-10H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine?
N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine has a molecular weight of 230.35 g/mol, XLogP of 0.72, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine is sourced from PubChem (CID 102657031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).