8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one

C17H20N4O3 — CID 16675080

IUPAC8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one
SMILESCOc1ccc2cc(C)c3nn(CN4CCOCC4)c(=O)n3c2c1
InChIInChI=1S/C17H20N4O3/c1-12-9-13-3-4-14(23-2)10-15(13)21-16(12)18-20(17(21)22)11-19-5-7-24-8-6-19/h3-4,9-10H,5-8,11H2,1-2H3
InChIKeyUBPCYXVLJQKJBO-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.26
Rot. Bonds3

About 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one

8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one (PubChem CID 16675080) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one.

Molecular Properties

Compound Name8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one
PubChem CID16675080
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one
SMILESCOc1ccc2cc(C)c3nn(CN4CCOCC4)c(=O)n3c2c1
InChIInChI=1S/C17H20N4O3/c1-12-9-13-3-4-14(23-2)10-15(13)21-16(12)18-20(17(21)22)11-19-5-7-24-8-6-19/h3-4,9-10H,5-8,11H2,1-2H3
InChIKeyUBPCYXVLJQKJBO-UHFFFAOYSA-N
XLogP1.26
TPSA61.00 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one with MolForge

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Related Compounds

7-methoxy-4-methyl-2-(2-piperidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one
CID 16668795
8-methoxy-4-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-[1,2,4]triazolo[4,3-a]quinolin-1-one
CID 16675154
2-(8-methoxy-4-methyl-1-oxo-[1,2,4]triazolo[4,3-a]quinolin-2-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 16675096
1-[(2-fluorophenyl)methyl]-7-methoxy-3-(morpholin-4-ylmethyl)quinolin-2-one
CID 26320725
2-(7-methoxy-4-methyl-1-oxo-[1,2,4]triazolo[4,3-a]quinolin-2-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 126468288
4-(4-methoxyphenyl)-2-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,2,4-triazole-3-thione
CID 14784001
8-methoxy-4-methyl-1-methylsulfanyl-[1,2,4]triazolo[4,3-a]quinoline
CID 859848
1-(azepan-1-yl)-2-[(8-methoxy-4-methyl-[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethanone
CID 1172095
4-[2-(7-methoxy-1-methylpyrido[3,4-b]indol-9-yl)ethyl]morpholine
CID 90463069
2-[[4-(4-methoxyphenyl)piperazin-1-yl]methyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
CID 17422926
4-amino-2-benzyl-8-methoxy-[1,2,4]triazolo[4,3-a]quinoxalin-1-one
CID 52939090
4-[2-(6-methoxynaphthalen-2-yl)propyl]morpholine
CID 3055313

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one?
The IUPAC name of 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one (CID 16675080) is 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one.
What is the SMILES notation for 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one?
The canonical SMILES for 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one is COc1ccc2cc(C)c3nn(CN4CCOCC4)c(=O)n3c2c1.
What is the InChIKey of 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one?
The InChIKey is UBPCYXVLJQKJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-12-9-13-3-4-14(23-2)10-15(13)21-16(12)18-20(17(21)22)11-19-5-7-24-8-6-19/h3-4,9-10H,5-8,11H2,1-2H3.
What are the key properties of 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one?
8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one has a molecular weight of 328.37 g/mol, XLogP of 1.26, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-4-methyl-2-(morpholin-4-ylmethyl)-[1,2,4]triazolo[4,3-a]quinolin-1-one is sourced from PubChem (CID 16675080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).