3-amino-5,6-dihydronaphthalen-2-ol

C10H11NO — CID 163497174

IUPAC3-amino-5,6-dihydronaphthalen-2-ol
SMILESNc1cc2c(cc1O)C=CCC2
InChIInChI=1S/C10H11NO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h2,4-6,12H,1,3,11H2
InChIKeyCRSCXGPUDPUAGT-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.93
Rot. Bonds

About 3-amino-5,6-dihydronaphthalen-2-ol

3-amino-5,6-dihydronaphthalen-2-ol (PubChem CID 163497174) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 3-amino-5,6-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name3-amino-5,6-dihydronaphthalen-2-ol
PubChem CID163497174
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name3-amino-5,6-dihydronaphthalen-2-ol
SMILESNc1cc2c(cc1O)C=CCC2
InChIInChI=1S/C10H11NO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h2,4-6,12H,1,3,11H2
InChIKeyCRSCXGPUDPUAGT-UHFFFAOYSA-N
XLogP1.93
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.93
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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Related Compounds

4-aminobicyclo[4.2.0]octa-1,3,5-trien-3-ol
CID 55290844
(E)-4-(3-hydroxy-5,6-dihydronaphthalen-2-yl)but-3-en-2-one
CID 166883346
1,2-dihydrotetracene
CID 526645
7-methyl-1,2-dihydronaphthalene
CID 123252357
7-iodo-1,2-dihydronaphthalene
CID 70927780
2,5-diaminobenzene-1,4-diol;dihydrobromide
CID 70601230
7-amino-2-methyl-3,4-dihydro-1H-isoquinolin-6-ol
CID 84656604
(3-methoxy-5,6-dihydronaphthalen-2-yl)methanol
CID 19841217
1-(5,6-dihydronaphthalen-2-yl)ethanol
CID 131969381
6-methylsulfonyl-1,2-dihydronaphthalene
CID 121321813
3-methoxy-7,8-dihydronaphthalene-2-carboxylic acid
CID 12738480
3,6-diamino-2,3-dihydro-1H-inden-5-ol
CID 55294365

Frequently Asked Questions

What is the IUPAC name of 3-amino-5,6-dihydronaphthalen-2-ol?
The IUPAC name of 3-amino-5,6-dihydronaphthalen-2-ol (CID 163497174) is 3-amino-5,6-dihydronaphthalen-2-ol.
What is the SMILES notation for 3-amino-5,6-dihydronaphthalen-2-ol?
The canonical SMILES for 3-amino-5,6-dihydronaphthalen-2-ol is Nc1cc2c(cc1O)C=CCC2.
What is the InChIKey of 3-amino-5,6-dihydronaphthalen-2-ol?
The InChIKey is CRSCXGPUDPUAGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h2,4-6,12H,1,3,11H2.
What are the key properties of 3-amino-5,6-dihydronaphthalen-2-ol?
3-amino-5,6-dihydronaphthalen-2-ol has a molecular weight of 161.20 g/mol, XLogP of 1.93, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5,6-dihydronaphthalen-2-ol is sourced from PubChem (CID 163497174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).