4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine

C24H22N8O — CID 147879203

IUPAC4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine
SMILESc1cnc2ccc(Cn3nnc4ncc(Cc5ccc(N6CCOCC6)cn5)nc43)cc2c1
InChIInChI=1S/C24H22N8O/c1-2-18-12-17(3-6-22(18)25-7-1)16-32-24-23(29-30-32)27-14-20(28-24)13-19-4-5-21(15-26-19)31-8-10-33-11-9-31/h1-7,12,14-15H,8-11,13,16H2
InChIKeyIACOVYJFEUCXRA-UHFFFAOYSA-N
MW438.50 g/mol
LogP2.64
Rot. Bonds5

About 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine

4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine (PubChem CID 147879203) has the molecular formula C24H22N8O and a molecular weight of 438.50 g/mol. Its IUPAC name is 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine
PubChem CID147879203
Molecular FormulaC24H22N8O
Molecular Weight438.50 g/mol
Exact Mass438.19
IUPAC Name4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine
SMILESc1cnc2ccc(Cn3nnc4ncc(Cc5ccc(N6CCOCC6)cn5)nc43)cc2c1
InChIInChI=1S/C24H22N8O/c1-2-18-12-17(3-6-22(18)25-7-1)16-32-24-23(29-30-32)27-14-20(28-24)13-19-4-5-21(15-26-19)31-8-10-33-11-9-31/h1-7,12,14-15H,8-11,13,16H2
InChIKeyIACOVYJFEUCXRA-UHFFFAOYSA-N
XLogP2.64
TPSA94.74 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.50
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine with MolForge

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Related Compounds

4-[1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrrolidin-3-yl]morpholine;hydrochloride
CID 24884478
N-methyl-2-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]pyridine-4-carboxamide
CID 153129012
N-methyl-2-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]pyridine-3-carboxamide
CID 148707526
1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]ethanol
CID 59341838
1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]ethanamine
CID 59341949
3-[(dimethylamino)methyl]-1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrrolidin-3-ol
CID 59341810
3-amino-1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrrolidine-3-carboxamide
CID 59341952
6-[[5-(1H-pyrazol-5-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline
CID 24852078
6-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline
CID 156790144
3-[(2-methylimidazol-1-yl)methyl]-1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrrolidin-3-ol
CID 59341954
N-[[2-fluoro-4-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]phenyl]-methylphosphoryl]ethanamine
CID 163754046
1-[(3S)-1-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]pyrrolidin-3-yl]piperidin-4-ol
CID 59341935

Frequently Asked Questions

What is the IUPAC name of 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine?
The IUPAC name of 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine (CID 147879203) is 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine.
What is the SMILES notation for 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine?
The canonical SMILES for 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine is c1cnc2ccc(Cn3nnc4ncc(Cc5ccc(N6CCOCC6)cn5)nc43)cc2c1.
What is the InChIKey of 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine?
The InChIKey is IACOVYJFEUCXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N8O/c1-2-18-12-17(3-6-22(18)25-7-1)16-32-24-23(29-30-32)27-14-20(28-24)13-19-4-5-21(15-26-19)31-8-10-33-11-9-31/h1-7,12,14-15H,8-11,13,16H2.
What are the key properties of 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine?
4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine has a molecular weight of 438.50 g/mol, XLogP of 2.64, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyrazin-5-yl]methyl]-3-pyridinyl]morpholine is sourced from PubChem (CID 147879203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).