1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine

C10H12FN3 — CID 83907515

IUPAC1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine
SMILESCNC(C)c1[nH]nc2ccc(F)cc12
InChIInChI=1S/C10H12FN3/c1-6(12-2)10-8-5-7(11)3-4-9(8)13-14-10/h3-6,12H,1-2H3,(H,13,14)
InChIKeyCHJGKPPLMXUYFG-UHFFFAOYSA-N
MW193.22 g/mol
LogP1.98
Rot. Bonds2

About 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine

1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine (PubChem CID 83907515) has the molecular formula C10H12FN3 and a molecular weight of 193.22 g/mol. Its IUPAC name is 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine
PubChem CID83907515
Molecular FormulaC10H12FN3
Molecular Weight193.22 g/mol
Exact Mass193.10
IUPAC Name1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine
SMILESCNC(C)c1[nH]nc2ccc(F)cc12
InChIInChI=1S/C10H12FN3/c1-6(12-2)10-8-5-7(11)3-4-9(8)13-14-10/h3-6,12H,1-2H3,(H,13,14)
InChIKeyCHJGKPPLMXUYFG-UHFFFAOYSA-N
XLogP1.98
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(1-Benzyl-piperidin-4-yl)-ethyl]-1H-indazole
CID 9996081
3-methyl-1H-indazole
CID 820804
3-(4-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo(4,3-c)pyridine
CID 16671966
(2S)-1-(6-fluoroindazol-1-yl)propan-2-amine
CID 9859429
(S)-1-(5-Fluoro-1H-indazol-1-yl)propan-2-amine
CID 44452853
3-(4-Fluorophenyl)-5-methyl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 44384655
N-(1-Benzylpiperidin-3-yl)-3-methyl-2H-indazol-5-amine
CID 44421899
3-(1-propylpiperidin-4-yl)-2H-indazole
CID 71463194
6-Fluoro-3-phenyl-1H-indazole
CID 164611597
3-phenyl-1H-indazole
CID 300385
3-(2-fluorophenyl)-4,5,6,7-tetrahydro-2H-pyrazolo[4,3-c]pyridine
CID 7426764
6-Fluoro-1H-indazole
CID 17842350

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine?
The IUPAC name of 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine (CID 83907515) is 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine.
What is the SMILES notation for 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine?
The canonical SMILES for 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine is CNC(C)c1[nH]nc2ccc(F)cc12.
What is the InChIKey of 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine?
The InChIKey is CHJGKPPLMXUYFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3/c1-6(12-2)10-8-5-7(11)3-4-9(8)13-14-10/h3-6,12H,1-2H3,(H,13,14).
What are the key properties of 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine?
1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine has a molecular weight of 193.22 g/mol, XLogP of 1.98, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2H-indazol-3-yl)-N-methylethanamine is sourced from PubChem (CID 83907515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).