1-amino-7-methyl-6,7-dihydronaphthalen-2-ol

C11H13NO — CID 89263459

IUPAC1-amino-7-methyl-6,7-dihydronaphthalen-2-ol
SMILESCC1C=c2c(N)c(O)ccc2=CC1
InChIInChI=1S/C11H13NO/c1-7-2-3-8-4-5-10(13)11(12)9(8)6-7/h3-7,13H,2,12H2,1H3
InChIKeyHRUQCEMGKVHATB-UHFFFAOYSA-N
MW175.23 g/mol
LogP0.58
Rot. Bonds

About 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol

1-amino-7-methyl-6,7-dihydronaphthalen-2-ol (PubChem CID 89263459) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name1-amino-7-methyl-6,7-dihydronaphthalen-2-ol
PubChem CID89263459
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name1-amino-7-methyl-6,7-dihydronaphthalen-2-ol
SMILESCC1C=c2c(N)c(O)ccc2=CC1
InChIInChI=1S/C11H13NO/c1-7-2-3-8-4-5-10(13)11(12)9(8)6-7/h3-7,13H,2,12H2,1H3
InChIKeyHRUQCEMGKVHATB-UHFFFAOYSA-N
XLogP0.58
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol?
The IUPAC name of 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol (CID 89263459) is 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol.
What is the SMILES notation for 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol?
The canonical SMILES for 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol is CC1C=c2c(N)c(O)ccc2=CC1.
What is the InChIKey of 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol?
The InChIKey is HRUQCEMGKVHATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-7-2-3-8-4-5-10(13)11(12)9(8)6-7/h3-7,13H,2,12H2,1H3.
What are the key properties of 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol?
1-amino-7-methyl-6,7-dihydronaphthalen-2-ol has a molecular weight of 175.23 g/mol, XLogP of 0.58, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-7-methyl-6,7-dihydronaphthalen-2-ol is sourced from PubChem (CID 89263459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).