6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol

C10H14N2O — CID 84656601

IUPAC6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol
SMILESCN1CCc2c(ccc(N)c2O)C1
InChIInChI=1S/C10H14N2O/c1-12-5-4-8-7(6-12)2-3-9(11)10(8)13/h2-3,13H,4-6,11H2,1H3
InChIKeyGAMNZHIMHZLQRB-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.96
Rot. Bonds

About 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol

6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol (PubChem CID 84656601) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol.

Molecular Properties

Compound Name6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol
PubChem CID84656601
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol
SMILESCN1CCc2c(ccc(N)c2O)C1
InChIInChI=1S/C10H14N2O/c1-12-5-4-8-7(6-12)2-3-9(11)10(8)13/h2-3,13H,4-6,11H2,1H3
InChIKeyGAMNZHIMHZLQRB-UHFFFAOYSA-N
XLogP0.96
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-bromo-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol
CID 84703152
2-methyl-3,4-dihydro-1H-isoquinoline-7,8-diamine
CID 10035152
7-amino-2-methyl-3,4-dihydro-1H-isoquinolin-6-ol
CID 84656604
6-amino-1,2,3,4-tetrahydroisoquinolin-5-ol
CID 84651923
7-iodo-2-methyl-3,4-dihydro-1H-isoquinolin-5-amine
CID 18687351
2-methyl-7-prop-1-en-2-yl-3,4-dihydro-1H-isoquinoline
CID 143924095
3-methyl-1,2,4,7,8,9-hexahydrocyclopenta[f]isoquinoline-5,6-diol
CID 3044687
5-chloro-2-methyl-6-propan-2-yl-3,4-dihydro-1H-isoquinoline
CID 162779153
methanol;2-methyl-3,4-dihydro-1H-isoquinoline
CID 142001874
2-methyl-3,4-dihydro-1H-isoquinoline-5-carbonitrile
CID 14528786
actinium;(2-methyl-3,4-dihydro-1H-isoquinolin-5-yl)azanide
CID 20633083
2-bromo-6-methoxy-3,4-dihydro-1H-isoquinolin-5-ol
CID 58602621

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol?
The IUPAC name of 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol (CID 84656601) is 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol.
What is the SMILES notation for 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol?
The canonical SMILES for 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol is CN1CCc2c(ccc(N)c2O)C1.
What is the InChIKey of 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol?
The InChIKey is GAMNZHIMHZLQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-12-5-4-8-7(6-12)2-3-9(11)10(8)13/h2-3,13H,4-6,11H2,1H3.
What are the key properties of 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol?
6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol has a molecular weight of 178.24 g/mol, XLogP of 0.96, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methyl-3,4-dihydro-1H-isoquinolin-5-ol is sourced from PubChem (CID 84656601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).