(5-fluoro-1-methylindazol-3-yl)methanamine

C9H10FN3 — CID 82600067

IUPAC(5-fluoro-1-methylindazol-3-yl)methanamine
SMILESCn1nc(CN)c2cc(F)ccc21
InChIInChI=1S/C9H10FN3/c1-13-9-3-2-6(10)4-7(9)8(5-11)12-13/h2-4H,5,11H2,1H3
InChIKeyFKIJFHFOJGPDJX-UHFFFAOYSA-N
MW179.20 g/mol
LogP1.17
Rot. Bonds1

About (5-fluoro-1-methylindazol-3-yl)methanamine

(5-fluoro-1-methylindazol-3-yl)methanamine (PubChem CID 82600067) has the molecular formula C9H10FN3 and a molecular weight of 179.20 g/mol. Its IUPAC name is (5-fluoro-1-methylindazol-3-yl)methanamine.

Molecular Properties

Compound Name(5-fluoro-1-methylindazol-3-yl)methanamine
PubChem CID82600067
Molecular FormulaC9H10FN3
Molecular Weight179.20 g/mol
Exact Mass179.09
IUPAC Name(5-fluoro-1-methylindazol-3-yl)methanamine
SMILESCn1nc(CN)c2cc(F)ccc21
InChIInChI=1S/C9H10FN3/c1-13-9-3-2-6(10)4-7(9)8(5-11)12-13/h2-4H,5,11H2,1H3
InChIKeyFKIJFHFOJGPDJX-UHFFFAOYSA-N
XLogP1.17
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.20
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-fluoro-1-methyl-3-(methylsulfonylmethyl)indazole
CID 123278139
2-N-(5-fluoro-1-methylindazol-3-yl)propane-1,2-diamine
CID 83838712
5-fluoro-1-methyl-3-propan-2-ylindazole
CID 118489326
3-ethyl-1-methylindazol-5-amine
CID 68609782
6-fluoro-1-methylindazol-3-amine
CID 15239650
5-fluoro-3-isocyanato-1-methylindazole
CID 83915484
5-fluoro-2-[(1-methylindazol-3-yl)methylsulfinyl]aniline
CID 81185159
6-fluoro-1,3-dimethylindazole
CID 59514053
(3-chloro-1-methylindazol-5-yl)methanamine
CID 83446741
(5-fluoro-1-methylbenzimidazol-2-yl)methanamine
CID 50988488
3-ethyl-1-methylindazole-5-carboxamide
CID 171772893
3-(aminomethyl)-6-fluoro-1,4-dimethylquinolin-2-one
CID 84623498

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-1-methylindazol-3-yl)methanamine?
The IUPAC name of (5-fluoro-1-methylindazol-3-yl)methanamine (CID 82600067) is (5-fluoro-1-methylindazol-3-yl)methanamine.
What is the SMILES notation for (5-fluoro-1-methylindazol-3-yl)methanamine?
The canonical SMILES for (5-fluoro-1-methylindazol-3-yl)methanamine is Cn1nc(CN)c2cc(F)ccc21.
What is the InChIKey of (5-fluoro-1-methylindazol-3-yl)methanamine?
The InChIKey is FKIJFHFOJGPDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN3/c1-13-9-3-2-6(10)4-7(9)8(5-11)12-13/h2-4H,5,11H2,1H3.
What are the key properties of (5-fluoro-1-methylindazol-3-yl)methanamine?
(5-fluoro-1-methylindazol-3-yl)methanamine has a molecular weight of 179.20 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-1-methylindazol-3-yl)methanamine is sourced from PubChem (CID 82600067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).