7-fluoro-6-methoxyisoquinolin-1-amine

C10H9FN2O — CID 82276421

IUPAC7-fluoro-6-methoxyisoquinolin-1-amine
SMILESCOc1cc2ccnc(N)c2cc1F
InChIInChI=1S/C10H9FN2O/c1-14-9-4-6-2-3-13-10(12)7(6)5-8(9)11/h2-5H,1H3,(H2,12,13)
InChIKeyBUICEGXZOQJELW-UHFFFAOYSA-N
MW192.19 g/mol
LogP1.96
Rot. Bonds1

About 7-fluoro-6-methoxyisoquinolin-1-amine

7-fluoro-6-methoxyisoquinolin-1-amine (PubChem CID 82276421) has the molecular formula C10H9FN2O and a molecular weight of 192.19 g/mol. Its IUPAC name is 7-fluoro-6-methoxyisoquinolin-1-amine.

Molecular Properties

Compound Name7-fluoro-6-methoxyisoquinolin-1-amine
PubChem CID82276421
Molecular FormulaC10H9FN2O
Molecular Weight192.19 g/mol
Exact Mass192.07
IUPAC Name7-fluoro-6-methoxyisoquinolin-1-amine
SMILESCOc1cc2ccnc(N)c2cc1F
InChIInChI=1S/C10H9FN2O/c1-14-9-4-6-2-3-13-10(12)7(6)5-8(9)11/h2-5H,1H3,(H2,12,13)
InChIKeyBUICEGXZOQJELW-UHFFFAOYSA-N
XLogP1.96
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.19
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 7-fluoro-6-methoxyisoquinolin-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(7-fluoro-6-methoxyisoquinolin-1-yl)methanamine
CID 82396051
2-(6,7-dimethoxyisoquinolin-1-yl)propan-2-amine
CID 116995177
6,7-dimethoxy-1-methylisoquinoline
CID 20725
(6,7-dimethoxyisoquinolin-1-yl)hydrazine
CID 103840464
4-[(7-fluoro-6-methoxyisoquinolin-1-yl)amino]-4-methylpentanoic acid
CID 122059013
tert-butyl N-(1-amino-7-methoxyisoquinolin-6-yl)-N-methylcarbamate
CID 121366465
7-methylisoquinolin-1-amine
CID 18727905
3-fluoro-2-methyl-1,7-naphthyridin-8-amine
CID 58896221
6-chloro-7-methylisoquinolin-1-amine
CID 21300587
1-(7-fluoro-6-methoxyisoquinolin-1-yl)-5-methylpiperidine-3-carboxylic acid
CID 122106452
6-N-benzyl-7-fluoroisoquinoline-1,6-diamine
CID 70924395
2-[4-(2,5-difluoro-4-methoxyphenyl)pyrimidin-2-yl]ethanamine
CID 116897723

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-methoxyisoquinolin-1-amine?
The IUPAC name of 7-fluoro-6-methoxyisoquinolin-1-amine (CID 82276421) is 7-fluoro-6-methoxyisoquinolin-1-amine.
What is the SMILES notation for 7-fluoro-6-methoxyisoquinolin-1-amine?
The canonical SMILES for 7-fluoro-6-methoxyisoquinolin-1-amine is COc1cc2ccnc(N)c2cc1F.
What is the InChIKey of 7-fluoro-6-methoxyisoquinolin-1-amine?
The InChIKey is BUICEGXZOQJELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2O/c1-14-9-4-6-2-3-13-10(12)7(6)5-8(9)11/h2-5H,1H3,(H2,12,13).
What are the key properties of 7-fluoro-6-methoxyisoquinolin-1-amine?
7-fluoro-6-methoxyisoquinolin-1-amine has a molecular weight of 192.19 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-methoxyisoquinolin-1-amine is sourced from PubChem (CID 82276421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).