6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine

C13H16FN3O — CID 145274776

IUPAC6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(OCC3CCCC3)cc(F)c12
InChIInChI=1S/C13H16FN3O/c14-10-5-9(18-7-8-3-1-2-4-8)6-11-12(10)13(15)17-16-11/h5-6,8H,1-4,7H2,(H3,15,16,17)
InChIKeyCFBYZLDKACXMBE-UHFFFAOYSA-N
MW249.29 g/mol
LogP2.85
Rot. Bonds3

About 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine

6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine (PubChem CID 145274776) has the molecular formula C13H16FN3O and a molecular weight of 249.29 g/mol. Its IUPAC name is 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine.

Molecular Properties

Compound Name6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine
PubChem CID145274776
Molecular FormulaC13H16FN3O
Molecular Weight249.29 g/mol
Exact Mass249.13
IUPAC Name6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine
SMILESNc1n[nH]c2cc(OCC3CCCC3)cc(F)c12
InChIInChI=1S/C13H16FN3O/c14-10-5-9(18-7-8-3-1-2-4-8)6-11-12(10)13(15)17-16-11/h5-6,8H,1-4,7H2,(H3,15,16,17)
InChIKeyCFBYZLDKACXMBE-UHFFFAOYSA-N
XLogP2.85
TPSA63.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.29
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-fluoro-6-[(1-methylazetidin-3-yl)methoxy]-1H-indazol-3-amine
CID 126696190
6-(cyclopent-2-en-1-ylmethoxy)-4-fluoro-1H-indazol-3-amine;methylcyclobutane
CID 145274731
6-[(1S)-1-[4-(cyclobutylmethylidene)cyclohexyl]ethoxy]-4-fluoro-1H-indazol-3-amine
CID 145274678
4-fluoro-6-[(1R)-1-[4-(2-methylpropylidene)cyclohexyl]ethoxy]-1H-indazol-3-amine
CID 126716628
6-(cyclohexylmethoxy)-4-fluoro-1H-indazole;methylcyclobutane
CID 145274702
4-fluoro-6-methyl-1H-indazol-3-amine
CID 66596243
6-ethyl-4-fluoro-1H-indazol-3-amine
CID 66596230
[4-(cyclopentylmethoxy)-2-fluorophenyl]boronic acid
CID 65203320
2-(cyclohexylmethoxy)-3,4-difluoroaniline
CID 62531491
3-(cyclopropylmethoxy)-5-fluoroaniline
CID 80751840
2-fluoro-4-(piperidin-3-ylmethoxy)aniline;dihydrochloride
CID 164576780
1-(cyclohexylmethoxy)-3-fluorobenzene
CID 60731171

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine?
The IUPAC name of 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine (CID 145274776) is 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine.
What is the SMILES notation for 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine?
The canonical SMILES for 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine is Nc1n[nH]c2cc(OCC3CCCC3)cc(F)c12.
What is the InChIKey of 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine?
The InChIKey is CFBYZLDKACXMBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3O/c14-10-5-9(18-7-8-3-1-2-4-8)6-11-12(10)13(15)17-16-11/h5-6,8H,1-4,7H2,(H3,15,16,17).
What are the key properties of 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine?
6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine has a molecular weight of 249.29 g/mol, XLogP of 2.85, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopentylmethoxy)-4-fluoro-1H-indazol-3-amine is sourced from PubChem (CID 145274776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).