6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine

C13H15FN4S — CID 175381914

IUPAC6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine
SMILESCc1c(F)c(N(C)C)c2[nH]ncc2c1N1C=CSC1
InChIInChI=1S/C13H15FN4S/c1-8-10(14)13(17(2)3)11-9(6-15-16-11)12(8)18-4-5-19-7-18/h4-6H,7H2,1-3H3,(H,15,16)
InChIKeyKPDNOSOIVVIOFR-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.06
Rot. Bonds2

About 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine

6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine (PubChem CID 175381914) has the molecular formula C13H15FN4S and a molecular weight of 278.36 g/mol. Its IUPAC name is 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine.

Molecular Properties

Compound Name6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine
PubChem CID175381914
Molecular FormulaC13H15FN4S
Molecular Weight278.36 g/mol
Exact Mass278.10
IUPAC Name6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine
SMILESCc1c(F)c(N(C)C)c2[nH]ncc2c1N1C=CSC1
InChIInChI=1S/C13H15FN4S/c1-8-10(14)13(17(2)3)11-9(6-15-16-11)12(8)18-4-5-19-7-18/h4-6H,7H2,1-3H3,(H,15,16)
InChIKeyKPDNOSOIVVIOFR-UHFFFAOYSA-N
XLogP3.06
TPSA35.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine with MolForge

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Related Compounds

3-(7-ethoxy-6-fluoro-5-methylsulfanyl-1H-indazol-4-yl)-2H-1,3-thiazole
CID 175381919
6-fluoro-N,N,5-trimethyl-4-(1,3-thiazol-5-yl)-1H-indazol-7-amine
CID 175750898
4-bromo-6-fluoro-N,N-dimethyl-5-methylsulfanyl-1H-indazol-7-amine
CID 163220447
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-N,N-dimethyl-4-[2-(methylamino)imidazo[1,2-a]pyridin-6-yl]-1H-indazol-7-amine
CID 163221163
4-fluoro-6-methyl-1H-indazole
CID 24728805
ethane;7-fluoro-4-methyl-1H-indazole
CID 163257667
N-[5-[7-[acetyl(methyl)amino]-6-fluoro-5-methyl-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 175707250
5-fluoro-4-methyl-1H-indazol-6-ol
CID 163233375
4-bromo-6-fluoro-5-methyl-1H-indazole
CID 139508183
cis-(1S,2S)-N-[5-[7-[[4-(dimethylamino)cyclohexyl]-methylamino]-6-fluoro-5-methyl-1H-indazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 167002538
cis-(1S,2S)-N-[6-[7-(dimethylamino)-6-fluoro-5-methoxy-1H-indazol-4-yl]imidazo[1,2-a]pyrazin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 169195946

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine?
The IUPAC name of 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine (CID 175381914) is 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine.
What is the SMILES notation for 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine?
The canonical SMILES for 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine is Cc1c(F)c(N(C)C)c2[nH]ncc2c1N1C=CSC1.
What is the InChIKey of 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine?
The InChIKey is KPDNOSOIVVIOFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4S/c1-8-10(14)13(17(2)3)11-9(6-15-16-11)12(8)18-4-5-19-7-18/h4-6H,7H2,1-3H3,(H,15,16).
What are the key properties of 6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine?
6-fluoro-N,N,5-trimethyl-4-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine has a molecular weight of 278.36 g/mol, XLogP of 3.06, 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-(2H-1,3-thiazol-3-yl)-1H-indazol-7-amine is sourced from PubChem (CID 175381914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).