N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine

C9H19N3 — CID 156546405

IUPACN,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine
SMILESCN1CC(N2CC(N(C)C)C2)C1
InChIInChI=1S/C9H19N3/c1-10(2)8-6-12(7-8)9-4-11(3)5-9/h8-9H,4-7H2,1-3H3
InChIKeyNPLGGNUYLSFIMC-UHFFFAOYSA-N
MW169.27 g/mol
LogP-0.45
Rot. Bonds2

About N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine

N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine (PubChem CID 156546405) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine
PubChem CID156546405
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC NameN,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine
SMILESCN1CC(N2CC(N(C)C)C2)C1
InChIInChI=1S/C9H19N3/c1-10(2)8-6-12(7-8)9-4-11(3)5-9/h8-9H,4-7H2,1-3H3
InChIKeyNPLGGNUYLSFIMC-UHFFFAOYSA-N
XLogP-0.45
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 5-0.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine?
The IUPAC name of N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine (CID 156546405) is N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine is CN1CC(N2CC(N(C)C)C2)C1.
What is the InChIKey of N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine?
The InChIKey is NPLGGNUYLSFIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c1-10(2)8-6-12(7-8)9-4-11(3)5-9/h8-9H,4-7H2,1-3H3.
What are the key properties of N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine?
N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine has a molecular weight of 169.27 g/mol, XLogP of -0.45, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine is sourced from PubChem (CID 156546405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).