N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine

C10H22N2 — CID 66186139

IUPACN-(3,3-dimethylbutyl)-N-methylazetidin-3-amine
SMILESCN(CCC(C)(C)C)C1CNC1
InChIInChI=1S/C10H22N2/c1-10(2,3)5-6-12(4)9-7-11-8-9/h9,11H,5-8H2,1-4H3
InChIKeyMEQUMDOFJUZHSR-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.33
Rot. Bonds3

About N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine

N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine (PubChem CID 66186139) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine.

Molecular Properties

Compound NameN-(3,3-dimethylbutyl)-N-methylazetidin-3-amine
PubChem CID66186139
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC NameN-(3,3-dimethylbutyl)-N-methylazetidin-3-amine
SMILESCN(CCC(C)(C)C)C1CNC1
InChIInChI=1S/C10H22N2/c1-10(2,3)5-6-12(4)9-7-11-8-9/h9,11H,5-8H2,1-4H3
InChIKeyMEQUMDOFJUZHSR-UHFFFAOYSA-N
XLogP1.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;N-methyl-N-propylazetidin-3-amine
CID 144899605
N-(2,2-difluoropropyl)-N-methylazetidin-3-amine
CID 84651854
N-heptyl-N-methylazetidin-3-amine
CID 66185882
N-methyl-N-nonylazetidin-3-amine
CID 66186670
ethane;N-methyl-N-(3-methylbutyl)azetidin-3-amine
CID 163376293
N-(2-methoxyethyl)-N-methylazetidin-3-amine;dihydrochloride
CID 137347103
N-methyl-N-(4-methylpentyl)azetidin-3-amine
CID 83158943
4-N-(3,3-dimethylbutyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122136
N-(2-cyclopropylsulfanylethyl)-N-methylazetidin-3-amine
CID 84660688
N-methyl-N-(2-propan-2-ylsulfonylethyl)azetidin-3-amine
CID 84686176
N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azetidin-3-amine
CID 82892705
N-(2,2-difluoroethyl)-N-methylazetidin-3-amine;ethane
CID 145168742

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine?
The IUPAC name of N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine (CID 66186139) is N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine.
What is the SMILES notation for N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine?
The canonical SMILES for N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine is CN(CCC(C)(C)C)C1CNC1.
What is the InChIKey of N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine?
The InChIKey is MEQUMDOFJUZHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2,3)5-6-12(4)9-7-11-8-9/h9,11H,5-8H2,1-4H3.
What are the key properties of N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine?
N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine has a molecular weight of 170.30 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutyl)-N-methylazetidin-3-amine is sourced from PubChem (CID 66186139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).