6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine

C13H13FN4S — CID 175750898

IUPAC6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine
SMILESCc1c(F)c(N(C)C)c2[nH]ncc2c1-c1cncs1
InChIInChI=1S/C13H13FN4S/c1-7-10(9-5-15-6-19-9)8-4-16-17-12(8)13(11(7)14)18(2)3/h4-6H,1-3H3,(H,16,17)
InChIKeyPVRKLNOVGJRPIC-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.20
Rot. Bonds2

About 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine

6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine (PubChem CID 175750898) has the molecular formula C13H13FN4S and a molecular weight of 276.34 g/mol. Its IUPAC name is 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine.

Molecular Properties

Compound Name6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine
PubChem CID175750898
Molecular FormulaC13H13FN4S
Molecular Weight276.34 g/mol
Exact Mass276.08
IUPAC Name6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine
SMILESCc1c(F)c(N(C)C)c2[nH]ncc2c1-c1cncs1
InChIInChI=1S/C13H13FN4S/c1-7-10(9-5-15-6-19-9)8-4-16-17-12(8)13(11(7)14)18(2)3/h4-6H,1-3H3,(H,16,17)
InChIKeyPVRKLNOVGJRPIC-UHFFFAOYSA-N
XLogP3.20
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(5-chloro-6-fluoro-7-methylsulfanyl-1H-indazol-4-yl)-1,3-thiazole
CID 175750890
6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine
CID 175381914
4-bromo-6-fluoro-N,N-dimethyl-5-methylsulfanyl-1H-indazol-7-amine
CID 163220447
5-chloro-6-fluoro-N,N-dimethyl-4-[2-(methylamino)imidazo[1,2-a]pyridin-6-yl]-1H-indazol-7-amine
CID 163221163
cis-(1S,2S)-N-[6-[7-(dimethylamino)-6-fluoro-5-methyl-1H-indazol-4-yl]imidazo[1,2-a]pyrazin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 164520637
5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
CID 163221063
5-(6,7-difluoro-5-methyl-1H-indazol-4-yl)-N-methylpyrazolo[1,5-a]pyridin-2-amine
CID 167002328
4-(2-aminopyrazolo[1,5-a]pyridin-5-yl)-6-fluoro-5-methyl-N-pyridin-4-yl-1H-indazol-7-amine
CID 167002429
(4-fluoro-5-methyl-1H-indazol-7-yl) thiohypochlorite
CID 164573640
N-[6-fluoro-4-[2-[[4-[(1S,2S)-2-fluorocyclopropyl]-2H-oxet-2-yl]amino]-[1,3]thiazolo[5,4-b]pyridin-5-yl]-5-methyl-1H-indazol-7-yl]-N-methylacetamide
CID 163221429
6-fluoro-4-[2-[[(1S,2S)-2-fluorocyclopropanecarbonyl]amino]-1,3-benzothiazol-6-yl]-N,N,5-trimethyl-1H-indazole-7-carboxamide
CID 164718328
5-fluoro-4-methyl-1H-indazol-6-ol
CID 163233375

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine?
The IUPAC name of 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine (CID 175750898) is 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine.
What is the SMILES notation for 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine?
The canonical SMILES for 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine is Cc1c(F)c(N(C)C)c2[nH]ncc2c1-c1cncs1.
What is the InChIKey of 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine?
The InChIKey is PVRKLNOVGJRPIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13FN4S/c1-7-10(9-5-15-6-19-9)8-4-16-17-12(8)13(11(7)14)18(2)3/h4-6H,1-3H3,(H,16,17).
What are the key properties of 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine?
6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine has a molecular weight of 276.34 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine is sourced from PubChem (CID 175750898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).