7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine

C8H10FN3 — CID 166076599

IUPAC7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine
SMILESCN1C=C2C(N)=CC=C(F)C2N1
InChIInChI=1S/C8H10FN3/c1-12-4-5-7(10)3-2-6(9)8(5)11-12/h2-4,8,11H,10H2,1H3
InChIKeyKGHYKOCRXVQCEA-UHFFFAOYSA-N
MW167.19 g/mol
LogP0.40
Rot. Bonds

About 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine

7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine (PubChem CID 166076599) has the molecular formula C8H10FN3 and a molecular weight of 167.19 g/mol. Its IUPAC name is 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine.

Molecular Properties

Compound Name7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine
PubChem CID166076599
Molecular FormulaC8H10FN3
Molecular Weight167.19 g/mol
Exact Mass167.09
IUPAC Name7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine
SMILESCN1C=C2C(N)=CC=C(F)C2N1
InChIInChI=1S/C8H10FN3/c1-12-4-5-7(10)3-2-6(9)8(5)11-12/h2-4,8,11H,10H2,1H3
InChIKeyKGHYKOCRXVQCEA-UHFFFAOYSA-N
XLogP0.40
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.19
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,2-Difluoroethyl)-1,7a-dihydroindazol-5-amine
CID 163989332
(7aS)-7-fluoro-2,7a-dimethyl-1H-indazol-5-amine
CID 176566847
(2E)-2-[(E)-3-fluorobut-2-enylidene]-4-methyl-3-methylidenepyrrol-1-amine
CID 142944784
3-fluoro-N,5-dimethyl-2-methylidenepyridin-1-amine
CID 147857381
3,5-Dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 58047454
2,5-Dimethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 58047670
6-Ethyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 89033267
6-Methyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 89976888
2,7-Dimethyl-1,7a-dihydroindazole
CID 90334627
2-Propan-2-yl-1,7a-dihydroindazole
CID 122468716
3-Methyl-1,3a-dihydropyrazolo[1,5-a]pyridine
CID 124130286
3-Propyl-1,2-dihydropyrazolo[1,5-a]pyridine
CID 135158445

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine?
The IUPAC name of 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine (CID 166076599) is 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine.
What is the SMILES notation for 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine?
The canonical SMILES for 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine is CN1C=C2C(N)=CC=C(F)C2N1.
What is the InChIKey of 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine?
The InChIKey is KGHYKOCRXVQCEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3/c1-12-4-5-7(10)3-2-6(9)8(5)11-12/h2-4,8,11H,10H2,1H3.
What are the key properties of 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine?
7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine has a molecular weight of 167.19 g/mol, XLogP of 0.40, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2-methyl-1,7a-dihydroindazol-4-amine is sourced from PubChem (CID 166076599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).