N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine

C15H14FN3O2 — CID 162651967

IUPACN-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine
SMILESCOc1ccc(Nc2n[nH]c3cc(F)ccc23)cc1OC
InChIInChI=1S/C15H14FN3O2/c1-20-13-6-4-10(8-14(13)21-2)17-15-11-5-3-9(16)7-12(11)18-19-15/h3-8H,1-2H3,(H2,17,18,19)
InChIKeyGXFPQONUJTVXNJ-UHFFFAOYSA-N
MW287.29 g/mol
LogP3.46
Rot. Bonds4

About N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine

N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine (PubChem CID 162651967) has the molecular formula C15H14FN3O2 and a molecular weight of 287.29 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine
PubChem CID162651967
Molecular FormulaC15H14FN3O2
Molecular Weight287.29 g/mol
Exact Mass287.11
IUPAC NameN-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine
SMILESCOc1ccc(Nc2n[nH]c3cc(F)ccc23)cc1OC
InChIInChI=1S/C15H14FN3O2/c1-20-13-6-4-10(8-14(13)21-2)17-15-11-5-3-9(16)7-12(11)18-19-15/h3-8H,1-2H3,(H2,17,18,19)
InChIKeyGXFPQONUJTVXNJ-UHFFFAOYSA-N
XLogP3.46
TPSA59.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-fluoro-N-methyl-1H-indazol-3-amine
CID 147996329
2-N-(3,4-dimethoxyphenyl)-4-N-(6-methoxy-1H-indazol-3-yl)pyrimidine-2,4-diamine
CID 71224603
N-(3,4-dimethoxyphenyl)-2-(3-fluorophenyl)-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 71729772
5-fluoro-N-(4-fluorophenyl)-2-methoxyaniline
CID 82537214
4-(3,4-dimethoxyanilino)-6,7-dimethoxy-1H-quinazoline-2-thione
CID 15994903
5-(3,4-dimethoxyanilino)-6-methyl-2H-1,2,4-triazine-3-thione
CID 23412306
3-N-(3,4-dimethoxyphenyl)-5-fluorobenzene-1,3-diamine
CID 60876893
3-N-(4-fluorophenyl)-1H-indazole-3,5-diamine
CID 69074655
N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473196
[2-[[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]amino]-2-oxoethyl] acetate
CID 69069713
2-chloro-N-(4-fluorophenyl)-6,7-dimethoxyquinazolin-4-amine
CID 22692700
N-[4-(difluoromethoxy)-3-methoxyphenyl]-8-methoxy-3H-pyrazolo[3,4-c]quinolin-1-amine
CID 154250514

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine?
The IUPAC name of N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine (CID 162651967) is N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine is COc1ccc(Nc2n[nH]c3cc(F)ccc23)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine?
The InChIKey is GXFPQONUJTVXNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2/c1-20-13-6-4-10(8-14(13)21-2)17-15-11-5-3-9(16)7-12(11)18-19-15/h3-8H,1-2H3,(H2,17,18,19).
What are the key properties of N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine?
N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine has a molecular weight of 287.29 g/mol, XLogP of 3.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-6-fluoro-1H-indazol-3-amine is sourced from PubChem (CID 162651967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).