(6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol

C10H12INO — CID 130642190

IUPAC(6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESN[C@H]1CCc2c(ccc(O)c2I)C1
InChIInChI=1S/C10H12INO/c11-10-8-3-2-7(12)5-6(8)1-4-9(10)13/h1,4,7,13H,2-3,5,12H2/t7-/m0/s1
InChIKeyAIWIGODLXSQEDB-ZETCQYMHSA-N
MW289.12 g/mol
LogP1.81
Rot. Bonds

About (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol

(6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol (PubChem CID 130642190) has the molecular formula C10H12INO and a molecular weight of 289.12 g/mol. Its IUPAC name is (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol.

Molecular Properties

Compound Name(6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol
PubChem CID130642190
Molecular FormulaC10H12INO
Molecular Weight289.12 g/mol
Exact Mass289.00
IUPAC Name(6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol
SMILESN[C@H]1CCc2c(ccc(O)c2I)C1
InChIInChI=1S/C10H12INO/c11-10-8-3-2-7(12)5-6(8)1-4-9(10)13/h1,4,7,13H,2-3,5,12H2/t7-/m0/s1
InChIKeyAIWIGODLXSQEDB-ZETCQYMHSA-N
XLogP1.81
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.12
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-amino-5,6,7,8-tetrahydronaphthalene-1,4-diol;hydrobromide
CID 90678179
(6S)-6-amino-5,6,7,8-tetrahydronaphthalene-1,2,3-triol
CID 55297577
(2R)-5-chloro-1,2,3,4-tetrahydronaphthalene-2,6-diamine
CID 130898043
(2R)-5-fluoro-6-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55294774
5,6,7,8-tetrahydronaphthalene-1,6-diamine
CID 14836578
(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-2,3-diol;hydrobromide
CID 70067167
N-[(6R)-6-amino-5,6,7,8-tetrahydronaphthalen-1-yl]acetamide;hydrochloride
CID 18650731
(2S)-6-fluoro-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine
CID 55268325
(6R)-6-amino-5,6,7,8-tetrahydronaphthalene-1-carbonitrile
CID 55294355
6-amino-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CID 23359820
(2S)-8-iodo-1,2,3,4-tetrahydronaphthalen-2-amine
CID 131030686
1,6-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 130033796

Frequently Asked Questions

What is the IUPAC name of (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol?
The IUPAC name of (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol (CID 130642190) is (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol.
What is the SMILES notation for (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol?
The canonical SMILES for (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol is N[C@H]1CCc2c(ccc(O)c2I)C1.
What is the InChIKey of (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol?
The InChIKey is AIWIGODLXSQEDB-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H12INO/c11-10-8-3-2-7(12)5-6(8)1-4-9(10)13/h1,4,7,13H,2-3,5,12H2/t7-/m0/s1.
What are the key properties of (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol?
(6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol has a molecular weight of 289.12 g/mol, XLogP of 1.81, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-amino-1-iodo-5,6,7,8-tetrahydronaphthalen-2-ol is sourced from PubChem (CID 130642190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).