3-(1-fluoroethyl)-1-methylindazol-4-amine

C10H12FN3 — CID 84664701

IUPAC3-(1-fluoroethyl)-1-methylindazol-4-amine
SMILESCC(F)c1nn(C)c2cccc(N)c12
InChIInChI=1S/C10H12FN3/c1-6(11)10-9-7(12)4-3-5-8(9)14(2)13-10/h3-6H,12H2,1-2H3
InChIKeyCCMKURJCYFUQRH-UHFFFAOYSA-N
MW193.22 g/mol
LogP2.19
Rot. Bonds1

About 3-(1-fluoroethyl)-1-methylindazol-4-amine

3-(1-fluoroethyl)-1-methylindazol-4-amine (PubChem CID 84664701) has the molecular formula C10H12FN3 and a molecular weight of 193.22 g/mol. Its IUPAC name is 3-(1-fluoroethyl)-1-methylindazol-4-amine.

Molecular Properties

Compound Name3-(1-fluoroethyl)-1-methylindazol-4-amine
PubChem CID84664701
Molecular FormulaC10H12FN3
Molecular Weight193.22 g/mol
Exact Mass193.10
IUPAC Name3-(1-fluoroethyl)-1-methylindazol-4-amine
SMILESCC(F)c1nn(C)c2cccc(N)c12
InChIInChI=1S/C10H12FN3/c1-6(11)10-9-7(12)4-3-5-8(9)14(2)13-10/h3-6H,12H2,1-2H3
InChIKeyCCMKURJCYFUQRH-UHFFFAOYSA-N
XLogP2.19
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.22
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(1-fluoroethyl)-1-methylindazol-4-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

1-(4-chloro-1-methylindazol-3-yl)ethanamine
CID 112716436
3-methoxy-1-methylindazol-4-amine
CID 133061084
1-(1-methyl-3-propan-2-ylindazol-4-yl)ethanamine
CID 105471767
(1-methyl-3-propan-2-ylindazol-4-yl)methanamine
CID 105455775
1-(4-fluoro-1-methylindazol-3-yl)-N-methylethanamine
CID 112716022
1-methyl-3-propan-2-ylindazole-4-carbaldehyde
CID 91549943
3-(difluoromethyl)-1-methylindazole
CID 153487584
3-N-cyclopropyl-1-methylindazole-3,4-diamine
CID 84670864
1-methyl-4-(trifluoromethyl)indazol-3-amine
CID 53403360
(1S)-1-(1-methylindazol-3-yl)ethanamine
CID 96741257
1,3-dimethyl-4-propan-2-ylindazole;ethane
CID 144655945
2,3-dimethylindazol-4-amine
CID 84716789

Frequently Asked Questions

What is the IUPAC name of 3-(1-fluoroethyl)-1-methylindazol-4-amine?
The IUPAC name of 3-(1-fluoroethyl)-1-methylindazol-4-amine (CID 84664701) is 3-(1-fluoroethyl)-1-methylindazol-4-amine.
What is the SMILES notation for 3-(1-fluoroethyl)-1-methylindazol-4-amine?
The canonical SMILES for 3-(1-fluoroethyl)-1-methylindazol-4-amine is CC(F)c1nn(C)c2cccc(N)c12.
What is the InChIKey of 3-(1-fluoroethyl)-1-methylindazol-4-amine?
The InChIKey is CCMKURJCYFUQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3/c1-6(11)10-9-7(12)4-3-5-8(9)14(2)13-10/h3-6H,12H2,1-2H3.
What are the key properties of 3-(1-fluoroethyl)-1-methylindazol-4-amine?
3-(1-fluoroethyl)-1-methylindazol-4-amine has a molecular weight of 193.22 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-fluoroethyl)-1-methylindazol-4-amine is sourced from PubChem (CID 84664701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).