2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride

C5H10ClNO — CID 162342151

IUPAC2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride
SMILESCl.NC1C2CCOC12
InChIInChI=1S/C5H9NO.ClH/c6-4-3-1-2-7-5(3)4;/h3-5H,1-2,6H2;1H
InChIKeyLSUUINWLSFQXJZ-UHFFFAOYSA-N
MW135.59 g/mol
LogP0.15
Rot. Bonds

About 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride

2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride (PubChem CID 162342151) has the molecular formula C5H10ClNO and a molecular weight of 135.59 g/mol. Its IUPAC name is 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride.

Molecular Properties

Compound Name2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride
PubChem CID162342151
Molecular FormulaC5H10ClNO
Molecular Weight135.59 g/mol
Exact Mass135.05
IUPAC Name2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride
SMILESCl.NC1C2CCOC12
InChIInChI=1S/C5H9NO.ClH/c6-4-3-1-2-7-5(3)4;/h3-5H,1-2,6H2;1H
InChIKeyLSUUINWLSFQXJZ-UHFFFAOYSA-N
XLogP0.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.59
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride?
The IUPAC name of 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride (CID 162342151) is 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride.
What is the SMILES notation for 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride?
The canonical SMILES for 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride is Cl.NC1C2CCOC12.
What is the InChIKey of 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride?
The InChIKey is LSUUINWLSFQXJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.ClH/c6-4-3-1-2-7-5(3)4;/h3-5H,1-2,6H2;1H.
What are the key properties of 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride?
2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride has a molecular weight of 135.59 g/mol, XLogP of 0.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxabicyclo[3.1.0]hexan-6-amine;hydrochloride is sourced from PubChem (CID 162342151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).