[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine

C15H14FN3O — CID 22260950

IUPAC[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine
SMILESCOc1c(CN)ccc2[nH]nc(-c3cccc(F)c3)c12
InChIInChI=1S/C15H14FN3O/c1-20-15-10(8-17)5-6-12-13(15)14(19-18-12)9-3-2-4-11(16)7-9/h2-7H,8,17H2,1H3,(H,18,19)
InChIKeyUTHOUHVVBVLMHT-UHFFFAOYSA-N
MW271.30 g/mol
LogP2.84
Rot. Bonds3

About [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine

[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine (PubChem CID 22260950) has the molecular formula C15H14FN3O and a molecular weight of 271.30 g/mol. Its IUPAC name is [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine.

Molecular Properties

Compound Name[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine
PubChem CID22260950
Molecular FormulaC15H14FN3O
Molecular Weight271.30 g/mol
Exact Mass271.11
IUPAC Name[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine
SMILESCOc1c(CN)ccc2[nH]nc(-c3cccc(F)c3)c12
InChIInChI=1S/C15H14FN3O/c1-20-15-10(8-17)5-6-12-13(15)14(19-18-12)9-3-2-4-11(16)7-9/h2-7H,8,17H2,1H3,(H,18,19)
InChIKeyUTHOUHVVBVLMHT-UHFFFAOYSA-N
XLogP2.84
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine 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

5-[(5-fluoro-3-methyl-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile
CID 25218427
5-[(3-ethyl-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile
CID 25218423
5-[(3-ethyl-5-fluoro-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile
CID 25195330
5-[(3-methyl-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile
CID 25218422
(E)-3-[4-[(E)-1-(4-methoxy-1H-indazol-5-yl)-2-phenylbut-1-enyl]phenyl]prop-2-enoic acid
CID 89820014
3,5-bis(4-propan-2-yloxyphenyl)-1H-indazole
CID 134179643
6-Methoxy-1H-indazole
CID 12639202
4-Methoxy-1H-indazole
CID 24729333
6-methoxy-5-[2-(trifluoromethyl)phenyl]-1H-indazole
CID 90645465
6-ethoxy-5-[2-(trifluoromethyl)phenyl]-1H-indazole
CID 90645466
6-propan-2-yloxy-5-[2-(trifluoromethyl)phenyl]-1H-indazole
CID 90645467
6-(cyclopropylmethoxy)-5-[2-(trifluoromethyl)phenyl]-1H-indazole
CID 90645468

Frequently Asked Questions

What is the IUPAC name of [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine?
The IUPAC name of [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine (CID 22260950) is [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine.
What is the SMILES notation for [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine?
The canonical SMILES for [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine is COc1c(CN)ccc2[nH]nc(-c3cccc(F)c3)c12.
What is the InChIKey of [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine?
The InChIKey is UTHOUHVVBVLMHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O/c1-20-15-10(8-17)5-6-12-13(15)14(19-18-12)9-3-2-4-11(16)7-9/h2-7H,8,17H2,1H3,(H,18,19).
What are the key properties of [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine?
[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine has a molecular weight of 271.30 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]methanamine is sourced from PubChem (CID 22260950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).