1-methyl-7-(trifluoromethyl)indazol-3-amine

C9H8F3N3 — CID 53403363

IUPAC1-methyl-7-(trifluoromethyl)indazol-3-amine
SMILESCn1nc(N)c2cccc(C(F)(F)F)c21
InChIInChI=1S/C9H8F3N3/c1-15-7-5(8(13)14-15)3-2-4-6(7)9(10,11)12/h2-4H,1H3,(H2,13,14)
InChIKeyNGPOCFQDJORDIL-UHFFFAOYSA-N
MW215.18 g/mol
LogP2.17
Rot. Bonds

About 1-methyl-7-(trifluoromethyl)indazol-3-amine

1-methyl-7-(trifluoromethyl)indazol-3-amine (PubChem CID 53403363) has the molecular formula C9H8F3N3 and a molecular weight of 215.18 g/mol. Its IUPAC name is 1-methyl-7-(trifluoromethyl)indazol-3-amine.

Molecular Properties

Compound Name1-methyl-7-(trifluoromethyl)indazol-3-amine
PubChem CID53403363
Molecular FormulaC9H8F3N3
Molecular Weight215.18 g/mol
Exact Mass215.07
IUPAC Name1-methyl-7-(trifluoromethyl)indazol-3-amine
SMILESCn1nc(N)c2cccc(C(F)(F)F)c21
InChIInChI=1S/C9H8F3N3/c1-15-7-5(8(13)14-15)3-2-4-6(7)9(10,11)12/h2-4H,1H3,(H2,13,14)
InChIKeyNGPOCFQDJORDIL-UHFFFAOYSA-N
XLogP2.17
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.18
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-(trifluoromethyl)indazol-3-amine
CID 53403360
1-methyl-3-[1-methyl-7-(trifluoromethyl)indol-3-yl]pyrazol-5-amine
CID 115108352
3-methyl-7-(trifluoromethyl)indazole-1-carbonitrile
CID 162550756
4-methyl-8-(trifluoromethyl)isoquinolin-1-amine
CID 115063049
2-chloro-8-(trifluoromethyl)quinazolin-4-amine
CID 34181622
5-[1,2-dimethyl-7-(trifluoromethyl)indol-3-yl]-1,2-oxazol-4-amine
CID 115108721
3-[1-methyl-7-(trifluoromethyl)indol-3-yl]-1,2-oxazol-5-amine
CID 115108348
2-[1,3-dimethyl-7-(trifluoromethyl)indol-2-yl]ethanamine
CID 83919995
3-[1-methyl-7-(trifluoromethyl)indol-3-yl]propan-1-amine
CID 117197311
2-[1-methyl-7-(trifluoromethyl)indol-3-yl]propan-2-ol
CID 117197297
3-(aminomethyl)-1-methyl-8-(trifluoromethyl)quinazoline-2,4-dione
CID 117263247
2-[1-propan-2-yl-7-(trifluoromethyl)indol-3-yl]ethanamine
CID 117197355

Frequently Asked Questions

What is the IUPAC name of 1-methyl-7-(trifluoromethyl)indazol-3-amine?
The IUPAC name of 1-methyl-7-(trifluoromethyl)indazol-3-amine (CID 53403363) is 1-methyl-7-(trifluoromethyl)indazol-3-amine.
What is the SMILES notation for 1-methyl-7-(trifluoromethyl)indazol-3-amine?
The canonical SMILES for 1-methyl-7-(trifluoromethyl)indazol-3-amine is Cn1nc(N)c2cccc(C(F)(F)F)c21.
What is the InChIKey of 1-methyl-7-(trifluoromethyl)indazol-3-amine?
The InChIKey is NGPOCFQDJORDIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3N3/c1-15-7-5(8(13)14-15)3-2-4-6(7)9(10,11)12/h2-4H,1H3,(H2,13,14).
What are the key properties of 1-methyl-7-(trifluoromethyl)indazol-3-amine?
1-methyl-7-(trifluoromethyl)indazol-3-amine has a molecular weight of 215.18 g/mol, XLogP of 2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7-(trifluoromethyl)indazol-3-amine is sourced from PubChem (CID 53403363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).