5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole

C16H12ClFN4 — CID 163221063

IUPAC5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
SMILESCc1cn2cc(-c3c(Cl)c(F)c(C)c4[nH]ncc34)ccc2n1
InChIInChI=1S/C16H12ClFN4/c1-8-6-22-7-10(3-4-12(22)20-8)13-11-5-19-21-16(11)9(2)15(18)14(13)17/h3-7H,1-2H3,(H,19,21)
InChIKeyMDNXRBFEVUYSNK-UHFFFAOYSA-N
MW314.75 g/mol
LogP4.29
Rot. Bonds1

About 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole

5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole (PubChem CID 163221063) has the molecular formula C16H12ClFN4 and a molecular weight of 314.75 g/mol. Its IUPAC name is 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole.

Molecular Properties

Compound Name5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
PubChem CID163221063
Molecular FormulaC16H12ClFN4
Molecular Weight314.75 g/mol
Exact Mass314.07
IUPAC Name5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
SMILESCc1cn2cc(-c3c(Cl)c(F)c(C)c4[nH]ncc34)ccc2n1
InChIInChI=1S/C16H12ClFN4/c1-8-6-22-7-10(3-4-12(22)20-8)13-11-5-19-21-16(11)9(2)15(18)14(13)17/h3-7H,1-2H3,(H,19,21)
InChIKeyMDNXRBFEVUYSNK-UHFFFAOYSA-N
XLogP4.29
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.75
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-6-fluoro-N,N-dimethyl-4-[2-(methylamino)imidazo[1,2-a]pyridin-6-yl]-1H-indazol-7-amine
CID 163221163
methyl 4-(2-aminoimidazo[1,2-a]pyridin-6-yl)-5-chloro-6-fluoro-1H-indazole-7-carboxylate
CID 163221409
5-chloro-6-fluoro-4-imidazo[1,2-a]pyridin-6-yl-7-propan-2-yl-1H-indazole
CID 175746767
5-bromo-6-fluoro-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
CID 163221343
N-[6-[5-chloro-6-fluoro-7-(2-hydroxypropan-2-yl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163221360
N-[6-[5-chloro-6-fluoro-7-(propan-2-ylamino)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163221228
5-bromo-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
CID 163221170
potassium;5-chloro-6-fluoro-4-[2-[methyl(oxido)amino]imidazo[1,2-a]pyridin-6-yl]-1H-indazole-7-carboxamide;cyclopropane
CID 163221281
ethane;5-ethyl-6-fluoro-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole
CID 163221187
N-[6-[5-chloro-7-(ethoxymethyl)-6-fluoro-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163221020
N-[6-[5-chloro-6-fluoro-7-(1-methoxypropyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]formamide
CID 163220935
cis-(1S,2S)-N-[6-[5-chloro-6-fluoro-7-(1-hydroxyethyl)-1H-indazol-4-yl]imidazo[1,2-a]pyridin-2-yl]-2-fluorocyclopropane-1-carboxamide
CID 164520285

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole?
The IUPAC name of 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole (CID 163221063) is 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole.
What is the SMILES notation for 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole?
The canonical SMILES for 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole is Cc1cn2cc(-c3c(Cl)c(F)c(C)c4[nH]ncc34)ccc2n1.
What is the InChIKey of 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole?
The InChIKey is MDNXRBFEVUYSNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClFN4/c1-8-6-22-7-10(3-4-12(22)20-8)13-11-5-19-21-16(11)9(2)15(18)14(13)17/h3-7H,1-2H3,(H,19,21).
What are the key properties of 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole?
5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole has a molecular weight of 314.75 g/mol, XLogP of 4.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-fluoro-7-methyl-4-(2-methylimidazo[1,2-a]pyridin-6-yl)-1H-indazole is sourced from PubChem (CID 163221063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).