N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine

C14H29N3O — CID 102657082

IUPACN,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine
SMILESCN(CCOC1(C)CNC1)CC1(N(C)C)CCC1
InChIInChI=1S/C14H29N3O/c1-13(10-15-11-13)18-9-8-17(4)12-14(16(2)3)6-5-7-14/h15H,5-12H2,1-4H3
InChIKeyFELHDAJMIKYVJD-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.78
Rot. Bonds7

About N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine

N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine (PubChem CID 102657082) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine
PubChem CID102657082
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine
SMILESCN(CCOC1(C)CNC1)CC1(N(C)C)CCC1
InChIInChI=1S/C14H29N3O/c1-13(10-15-11-13)18-9-8-17(4)12-14(16(2)3)6-5-7-14/h15H,5-12H2,1-4H3
InChIKeyFELHDAJMIKYVJD-UHFFFAOYSA-N
XLogP0.78
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[3-bromopropyl(methyl)amino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105416269
N,N,N'-trimethyl-N'-[2-(3-methylazetidin-3-yl)oxyethyl]ethane-1,2-diamine
CID 102656937
N,N,N'-trimethyl-N'-[2-(3-methylazetidin-3-yl)oxyethyl]propane-1,3-diamine
CID 102656938
N-methyl-2-(3-methylazetidin-3-yl)oxy-N-(2-methylsulfanylethyl)ethanamine
CID 102657036
N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]cyclobutanamine
CID 102657060
N,N-dimethyl-1-[[methyl(2-piperazin-1-ylethyl)amino]methyl]cyclobutan-1-amine
CID 105414842
4-[2-[[1-(dimethylamino)cyclobutyl]methyl-methylamino]ethoxy]benzonitrile
CID 105414678
1-[[2-(1,4-diazepan-1-yl)ethyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105421291
N-(2-methoxyethyl)-N-[2-(3-methylazetidin-3-yl)oxyethyl]propan-2-amine
CID 102657031
1-N-[[1-(dimethylamino)cyclobutyl]methyl]-1-N,3-N-dimethylbutane-1,3-diamine
CID 105414306
1-N-[[1-(dimethylamino)cyclobutyl]methyl]-1-N-methylpentane-1,4-diamine
CID 105414329
N'-[[1-(dimethylamino)cyclobutyl]methyl]-2-ethyl-N'-methylbutane-1,4-diamine
CID 105421320

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine?
The IUPAC name of N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine (CID 102657082) is N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine.
What is the SMILES notation for N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine?
The canonical SMILES for N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine is CN(CCOC1(C)CNC1)CC1(N(C)C)CCC1.
What is the InChIKey of N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine?
The InChIKey is FELHDAJMIKYVJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-13(10-15-11-13)18-9-8-17(4)12-14(16(2)3)6-5-7-14/h15H,5-12H2,1-4H3.
What are the key properties of N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine?
N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine has a molecular weight of 255.41 g/mol, XLogP of 0.78, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[[methyl-[2-(3-methylazetidin-3-yl)oxyethyl]amino]methyl]cyclobutan-1-amine is sourced from PubChem (CID 102657082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).