[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride

C11H15ClIN — CID 66651510

IUPAC[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
SMILESCl.NC[C@@H]1CCCc2cc(I)ccc21
InChIInChI=1S/C11H14IN.ClH/c12-10-4-5-11-8(6-10)2-1-3-9(11)7-13;/h4-6,9H,1-3,7,13H2;1H/t9-;/m0./s1
InChIKeyFMQGWBPNIGQDBW-FVGYRXGTSA-N
MW323.61 g/mol
LogP3.09
Rot. Bonds1

About [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride

[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride (PubChem CID 66651510) has the molecular formula C11H15ClIN and a molecular weight of 323.61 g/mol. Its IUPAC name is [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride.

Molecular Properties

Compound Name[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
PubChem CID66651510
Molecular FormulaC11H15ClIN
Molecular Weight323.61 g/mol
Exact Mass322.99
IUPAC Name[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
SMILESCl.NC[C@@H]1CCCc2cc(I)ccc21
InChIInChI=1S/C11H14IN.ClH/c12-10-4-5-11-8(6-10)2-1-3-9(11)7-13;/h4-6,9H,1-3,7,13H2;1H/t9-;/m0./s1
InChIKeyFMQGWBPNIGQDBW-FVGYRXGTSA-N
XLogP3.09
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.61
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
The IUPAC name of [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride (CID 66651510) is [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride.
What is the SMILES notation for [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
The canonical SMILES for [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride is Cl.NC[C@@H]1CCCc2cc(I)ccc21.
What is the InChIKey of [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
The InChIKey is FMQGWBPNIGQDBW-FVGYRXGTSA-N. The full InChI is InChI=1S/C11H14IN.ClH/c12-10-4-5-11-8(6-10)2-1-3-9(11)7-13;/h4-6,9H,1-3,7,13H2;1H/t9-;/m0./s1.
What are the key properties of [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride?
[(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride has a molecular weight of 323.61 g/mol, XLogP of 3.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-6-iodo-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride is sourced from PubChem (CID 66651510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).