6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline

C23H22N8 — CID 67224038

IUPAC6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline
SMILESc1cnc2ccc(Cc3cnc4ncc(-c5cnn(C6CCNCC6)c5)nn34)cc2c1
InChIInChI=1S/C23H22N8/c1-2-17-10-16(3-4-21(17)25-7-1)11-20-13-26-23-27-14-22(29-31(20)23)18-12-28-30(15-18)19-5-8-24-9-6-19/h1-4,7,10,12-15,19,24H,5-6,8-9,11H2
InChIKeyLDOWBCUASOSYDJ-UHFFFAOYSA-N
MW410.49 g/mol
LogP3.05
Rot. Bonds4

About 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline

6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline (PubChem CID 67224038) has the molecular formula C23H22N8 and a molecular weight of 410.49 g/mol. Its IUPAC name is 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline.

Molecular Properties

Compound Name6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline
PubChem CID67224038
Molecular FormulaC23H22N8
Molecular Weight410.49 g/mol
Exact Mass410.20
IUPAC Name6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline
SMILESc1cnc2ccc(Cc3cnc4ncc(-c5cnn(C6CCNCC6)c5)nn34)cc2c1
InChIInChI=1S/C23H22N8/c1-2-17-10-16(3-4-21(17)25-7-1)11-20-13-26-23-27-14-22(29-31(20)23)18-12-28-30(15-18)19-5-8-24-9-6-19/h1-4,7,10,12-15,19,24H,5-6,8-9,11H2
InChIKeyLDOWBCUASOSYDJ-UHFFFAOYSA-N
XLogP3.05
TPSA85.82 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.49
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

3-[4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]pyrazol-1-yl]propanenitrile
CID 59420936
6-[[2-(3-fluorophenyl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline
CID 141215044
6-[[5-[1-[(3S)-pyrrolidin-3-yl]pyrazol-4-yl]triazolo[4,5-b]pyridin-3-yl]methyl]quinoline;hydrochloride
CID 66995540
N-cyclopropyl-2-fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide
CID 59420970
2-fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzoic acid;dihydrochloride
CID 67027449
2-fluoro-N-[(1S,2S)-2-hydroxycyclopentyl]-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide
CID 59420964
methyl 4-(cyanomethyl)-4-[4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]pyrazol-1-yl]piperidine-1-carboxylate
CID 59420992
6-[1-[6-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-a]pyrimidin-3-yl]cyclopropyl]quinoline
CID 67225099
trans-(1S,2S)-2-[[[2-fluoro-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]phenyl]-hydroxymethyl]amino]cyclopentan-1-ol
CID 166562842
2-fluoro-N'-(pyridin-2-ylmethyl)-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzenecarboximidamide
CID 135247078
2-fluoro-N-propyl-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide
CID 134566434
2-fluoro-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[7-(quinolin-6-ylmethyl)imidazo[1,2-b][1,2,4]triazin-2-yl]benzamide
CID 59420921

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline?
The IUPAC name of 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline (CID 67224038) is 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline.
What is the SMILES notation for 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline?
The canonical SMILES for 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline is c1cnc2ccc(Cc3cnc4ncc(-c5cnn(C6CCNCC6)c5)nn34)cc2c1.
What is the InChIKey of 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline?
The InChIKey is LDOWBCUASOSYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N8/c1-2-17-10-16(3-4-21(17)25-7-1)11-20-13-26-23-27-14-22(29-31(20)23)18-12-28-30(15-18)19-5-8-24-9-6-19/h1-4,7,10,12-15,19,24H,5-6,8-9,11H2.
What are the key properties of 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline?
6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline has a molecular weight of 410.49 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(1-piperidin-4-ylpyrazol-4-yl)imidazo[1,2-b][1,2,4]triazin-7-yl]methyl]quinoline is sourced from PubChem (CID 67224038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).