N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine

C18H19FN8 — CID 176566986

IUPACN-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCc1cn2cc(Nc3n[nH]c4cc(N5CCNCC5)cnc34)cc(F)c2n1
InChIInChI=1S/C18H19FN8/c1-11-9-27-10-12(6-14(19)18(27)22-11)23-17-16-15(24-25-17)7-13(8-21-16)26-4-2-20-3-5-26/h6-10,20H,2-5H2,1H3,(H2,23,24,25)
InChIKeyXUFOBUVRFCRSBH-UHFFFAOYSA-N
MW366.40 g/mol
LogP2.21
Rot. Bonds3

About N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine

N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 176566986) has the molecular formula C18H19FN8 and a molecular weight of 366.40 g/mol. Its IUPAC name is N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID176566986
Molecular FormulaC18H19FN8
Molecular Weight366.40 g/mol
Exact Mass366.17
IUPAC NameN-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESCc1cn2cc(Nc3n[nH]c4cc(N5CCNCC5)cnc34)cc(F)c2n1
InChIInChI=1S/C18H19FN8/c1-11-9-27-10-12(6-14(19)18(27)22-11)23-17-16-15(24-25-17)7-13(8-21-16)26-4-2-20-3-5-26/h6-10,20H,2-5H2,1H3,(H2,23,24,25)
InChIKeyXUFOBUVRFCRSBH-UHFFFAOYSA-N
XLogP2.21
TPSA86.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

8-fluoro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-ylphthalazin-1-amine
CID 176567350
5-dimethylphosphoryl-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-indazol-3-amine
CID 176565939
8-fluoro-2-methyl-N-(6-piperidin-4-yl-1H-indazol-3-yl)imidazo[1,2-a]pyridin-6-amine
CID 176566276
N-(4-chloro-6-piperazin-1-yl-1H-indazol-3-yl)-8-fluoro-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 176566106
ethane;2-ethyl-4-fluoro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-ylindazol-3-amine
CID 176566098
4-chloro-2-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1,8-naphthyridine
CID 168979090
N-[4-chloro-6-[(3S,5R)-3-[4-[[3-[(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)amino]-6-piperazin-1-yl-1H-indazol-4-yl]sulfanylmethyl]phenyl]-5-methylpiperazin-1-yl]-1H-indazol-3-yl]-7-fluoro-2-methylindazol-5-amine
CID 176566943
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-7-piperazin-1-yl-2H-benzotriazole-4-carboxamide
CID 167501514
2,8-dimethyl-N-(6-piperazin-1-yl-1H-indazol-3-yl)imidazo[1,2-b]pyridazin-6-amine
CID 176566898
ethane;8-fluoro-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperidin-4-ylisoquinolin-1-amine
CID 176567438
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-3-methoxy-8-piperazin-1-ylquinoxaline-5-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 167500340
4-chloro-N-(8-chloro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-[(3S,5S)-3,5-dimethylpiperazin-1-yl]-1H-indazol-3-amine
CID 176566176

Frequently Asked Questions

What is the IUPAC name of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 176566986) is N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine is Cc1cn2cc(Nc3n[nH]c4cc(N5CCNCC5)cnc34)cc(F)c2n1.
What is the InChIKey of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is XUFOBUVRFCRSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN8/c1-11-9-27-10-12(6-14(19)18(27)22-11)23-17-16-15(24-25-17)7-13(8-21-16)26-4-2-20-3-5-26/h6-10,20H,2-5H2,1H3,(H2,23,24,25).
What are the key properties of N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 366.40 g/mol, XLogP of 2.21, 3 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-6-piperazin-1-yl-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 176566986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).