2-azabicyclo[2.1.0]pentane;hydrochloride

C4H8ClN — CID 67309553

IUPAC2-azabicyclo[2.1.0]pentane;hydrochloride
SMILESC1NC2CC12.Cl
InChIInChI=1S/C4H7N.ClH/c1-3-2-5-4(1)3;/h3-5H,1-2H2;1H
InChIKeyPEVSGRYLLDXSAY-UHFFFAOYSA-N
MW105.57 g/mol
LogP0.40
Rot. Bonds

About 2-azabicyclo[2.1.0]pentane;hydrochloride

2-azabicyclo[2.1.0]pentane;hydrochloride (PubChem CID 67309553) has the molecular formula C4H8ClN and a molecular weight of 105.57 g/mol. Its IUPAC name is 2-azabicyclo[2.1.0]pentane;hydrochloride.

Molecular Properties

Compound Name2-azabicyclo[2.1.0]pentane;hydrochloride
PubChem CID67309553
Molecular FormulaC4H8ClN
Molecular Weight105.57 g/mol
Exact Mass105.03
IUPAC Name2-azabicyclo[2.1.0]pentane;hydrochloride
SMILESC1NC2CC12.Cl
InChIInChI=1S/C4H7N.ClH/c1-3-2-5-4(1)3;/h3-5H,1-2H2;1H
InChIKeyPEVSGRYLLDXSAY-UHFFFAOYSA-N
XLogP0.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.57
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-azabicyclo[2.1.0]pentane;hydrochloride?
The IUPAC name of 2-azabicyclo[2.1.0]pentane;hydrochloride (CID 67309553) is 2-azabicyclo[2.1.0]pentane;hydrochloride.
What is the SMILES notation for 2-azabicyclo[2.1.0]pentane;hydrochloride?
The canonical SMILES for 2-azabicyclo[2.1.0]pentane;hydrochloride is C1NC2CC12.Cl.
What is the InChIKey of 2-azabicyclo[2.1.0]pentane;hydrochloride?
The InChIKey is PEVSGRYLLDXSAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N.ClH/c1-3-2-5-4(1)3;/h3-5H,1-2H2;1H.
What are the key properties of 2-azabicyclo[2.1.0]pentane;hydrochloride?
2-azabicyclo[2.1.0]pentane;hydrochloride has a molecular weight of 105.57 g/mol, XLogP of 0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azabicyclo[2.1.0]pentane;hydrochloride is sourced from PubChem (CID 67309553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).