1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol

C11H13N3O — CID 106539287

IUPAC1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol
SMILESCN(C)Nc1nccc2ccc(O)cc12
InChIInChI=1S/C11H13N3O/c1-14(2)13-11-10-7-9(15)4-3-8(10)5-6-12-11/h3-7,15H,1-2H3,(H,12,13)
InChIKeyLAPMQHUSMRTQLU-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.83
Rot. Bonds2

About 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol

1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol (PubChem CID 106539287) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol.

Molecular Properties

Compound Name1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol
PubChem CID106539287
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol
SMILESCN(C)Nc1nccc2ccc(O)cc12
InChIInChI=1S/C11H13N3O/c1-14(2)13-11-10-7-9(15)4-3-8(10)5-6-12-11/h3-7,15H,1-2H3,(H,12,13)
InChIKeyLAPMQHUSMRTQLU-UHFFFAOYSA-N
XLogP1.83
TPSA48.39 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[2-[(7-hydroxyisoquinolin-1-yl)amino]ethyl]-1,1-dimethylurea
CID 106539324
2-[(7-hydroxyisoquinolin-1-yl)amino]propane-1,3-diol
CID 106538911
N-ethyl-2-[(7-hydroxyisoquinolin-1-yl)amino]-N-methylpropanamide
CID 106540035
1-[(4-bromo-3-methylbutan-2-yl)amino]isoquinolin-7-ol
CID 106543097
1-[(3-chloro-2-methylbutan-2-yl)amino]isoquinolin-7-ol
CID 106543172
2-[(7-hydroxyisoquinolin-1-yl)amino]-3-methylbutanoic acid
CID 106536074
1-[(1-amino-2-methylbutan-2-yl)amino]isoquinolin-7-ol
CID 106543374
N,N-diethyl-3-[(7-hydroxyisoquinolin-1-yl)amino]propanamide
CID 106537734
N-[2-[(7-hydroxyisoquinolin-1-yl)amino]ethyl]methanesulfonamide
CID 106537595
1-[(4-hydroxy-2-methylbutyl)amino]isoquinolin-7-ol
CID 106538999
1-(5-methylhexylamino)isoquinolin-7-ol
CID 106539204
1-(1-cyclobutylethylamino)isoquinolin-7-ol
CID 106539803

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol?
The IUPAC name of 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol (CID 106539287) is 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol.
What is the SMILES notation for 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol?
The canonical SMILES for 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol is CN(C)Nc1nccc2ccc(O)cc12.
What is the InChIKey of 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol?
The InChIKey is LAPMQHUSMRTQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-14(2)13-11-10-7-9(15)4-3-8(10)5-6-12-11/h3-7,15H,1-2H3,(H,12,13).
What are the key properties of 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol?
1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol has a molecular weight of 203.24 g/mol, XLogP of 1.83, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylhydrazinyl)isoquinolin-7-ol is sourced from PubChem (CID 106539287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).