(1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride

C6H12ClN — CID 86812296

IUPAC(1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride
SMILESCl.NC1[C@H]2CCC[C@@H]12
InChIInChI=1S/C6H11N.ClH/c7-6-4-2-1-3-5(4)6;/h4-6H,1-3,7H2;1H/t4-,5+,6?;
InChIKeyGMUSZZUZWUXLCP-FTEHNKOGSA-N
MW133.62 g/mol
LogP1.17
Rot. Bonds

About (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride

(1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride (PubChem CID 86812296) has the molecular formula C6H12ClN and a molecular weight of 133.62 g/mol. Its IUPAC name is (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride.

Molecular Properties

Compound Name(1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride
PubChem CID86812296
Molecular FormulaC6H12ClN
Molecular Weight133.62 g/mol
Exact Mass133.07
IUPAC Name(1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride
SMILESCl.NC1[C@H]2CCC[C@@H]12
InChIInChI=1S/C6H11N.ClH/c7-6-4-2-1-3-5(4)6;/h4-6H,1-3,7H2;1H/t4-,5+,6?;
InChIKeyGMUSZZUZWUXLCP-FTEHNKOGSA-N
XLogP1.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.62
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride?
The IUPAC name of (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride (CID 86812296) is (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride.
What is the SMILES notation for (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride?
The canonical SMILES for (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride is Cl.NC1[C@H]2CCC[C@@H]12.
What is the InChIKey of (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride?
The InChIKey is GMUSZZUZWUXLCP-FTEHNKOGSA-N. The full InChI is InChI=1S/C6H11N.ClH/c7-6-4-2-1-3-5(4)6;/h4-6H,1-3,7H2;1H/t4-,5+,6?;.
What are the key properties of (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride?
(1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride has a molecular weight of 133.62 g/mol, XLogP of 1.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,5R)-bicyclo[3.1.0]hexan-6-amine;hydrochloride is sourced from PubChem (CID 86812296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).