N-(3-methylazetidin-3-yl)acetamide;hydrobromide

C6H13BrN2O — CID 170917986

IUPACN-(3-methylazetidin-3-yl)acetamide;hydrobromide
SMILESBr.CC(=O)NC1(C)CNC1
InChIInChI=1S/C6H12N2O.BrH/c1-5(9)8-6(2)3-7-4-6;/h7H,3-4H2,1-2H3,(H,8,9);1H
InChIKeyZMYNSDPLVPFVRD-UHFFFAOYSA-N
MW209.09 g/mol
LogP0.06
Rot. Bonds1

About N-(3-methylazetidin-3-yl)acetamide;hydrobromide

N-(3-methylazetidin-3-yl)acetamide;hydrobromide (PubChem CID 170917986) has the molecular formula C6H13BrN2O and a molecular weight of 209.09 g/mol. Its IUPAC name is N-(3-methylazetidin-3-yl)acetamide;hydrobromide.

Molecular Properties

Compound NameN-(3-methylazetidin-3-yl)acetamide;hydrobromide
PubChem CID170917986
Molecular FormulaC6H13BrN2O
Molecular Weight209.09 g/mol
Exact Mass208.02
IUPAC NameN-(3-methylazetidin-3-yl)acetamide;hydrobromide
SMILESBr.CC(=O)NC1(C)CNC1
InChIInChI=1S/C6H12N2O.BrH/c1-5(9)8-6(2)3-7-4-6;/h7H,3-4H2,1-2H3,(H,8,9);1H
InChIKeyZMYNSDPLVPFVRD-UHFFFAOYSA-N
XLogP0.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.09
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-Amino-3-methylazetidin-1-yl)ethan-1-one
CID 65951496
N-(azetidin-3-yl)acetamide
CID 13401968
N-(azetidin-3-yl)propanamide
CID 66186982
Acetamide, N-(2-amino-2-methylpropyl)-
CID 9793774
3-Methyl-3-trifluoroacetamidoazetidine hydrochloride
CID 20087919
2,2,2-trifluoro-N-(3-methylazetidin-3-yl)acetamide
CID 20087920
N-[(azetidin-2-yl)methyl]acetamide
CID 84047619
N-[3-(2,2-difluoroethyl)azetidin-3-yl]acetamide
CID 130691680
N-(2-Amino-1,1-dimethylethyl)acetamide
CID 18526358
N-[2-(azetidin-1-yl)ethyl]acetamide
CID 20692611
N-(1-methylazetidin-3-yl)acetamide
CID 21611771
N-[2-methyl-2-(methylamino)propyl]acetamide
CID 55288454

Frequently Asked Questions

What is the IUPAC name of N-(3-methylazetidin-3-yl)acetamide;hydrobromide?
The IUPAC name of N-(3-methylazetidin-3-yl)acetamide;hydrobromide (CID 170917986) is N-(3-methylazetidin-3-yl)acetamide;hydrobromide.
What is the SMILES notation for N-(3-methylazetidin-3-yl)acetamide;hydrobromide?
The canonical SMILES for N-(3-methylazetidin-3-yl)acetamide;hydrobromide is Br.CC(=O)NC1(C)CNC1.
What is the InChIKey of N-(3-methylazetidin-3-yl)acetamide;hydrobromide?
The InChIKey is ZMYNSDPLVPFVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.BrH/c1-5(9)8-6(2)3-7-4-6;/h7H,3-4H2,1-2H3,(H,8,9);1H.
What are the key properties of N-(3-methylazetidin-3-yl)acetamide;hydrobromide?
N-(3-methylazetidin-3-yl)acetamide;hydrobromide has a molecular weight of 209.09 g/mol, XLogP of 0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylazetidin-3-yl)acetamide;hydrobromide is sourced from PubChem (CID 170917986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).