1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol

C11H9N3O — CID 123586465

IUPAC1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol
SMILESCc1nnc2c(O)cc3ccccc3n12
InChIInChI=1S/C11H9N3O/c1-7-12-13-11-10(15)6-8-4-2-3-5-9(8)14(7)11/h2-6,15H,1H3
InChIKeyVXGXGSKNYMWHSX-UHFFFAOYSA-N
MW199.21 g/mol
LogP1.90
Rot. Bonds

About 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol

1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol (PubChem CID 123586465) has the molecular formula C11H9N3O and a molecular weight of 199.21 g/mol. Its IUPAC name is 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol.

Molecular Properties

Compound Name1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol
PubChem CID123586465
Molecular FormulaC11H9N3O
Molecular Weight199.21 g/mol
Exact Mass199.07
IUPAC Name1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol
SMILESCc1nnc2c(O)cc3ccccc3n12
InChIInChI=1S/C11H9N3O/c1-7-12-13-11-10(15)6-8-4-2-3-5-9(8)14(7)11/h2-6,15H,1H3
InChIKeyVXGXGSKNYMWHSX-UHFFFAOYSA-N
XLogP1.90
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.21
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-2-[(1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)amino]phenol
CID 135548693
10-methyl-2,3,4,5,8,9,11-heptazatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),3,5,7,9,12,14-heptaene
CID 12933159
N-(3,5-dimethylphenyl)-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 22431969
1-methyl-N-phenyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 45106063
N-(2,4-dimethylphenyl)-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 22431976
1-methyl-4-[(3-methylphenyl)methylsulfanyl]-[1,2,4]triazolo[4,3-a]quinoxaline
CID 50743321
3-hydroxy-2-oxoquinoline-1-carbonitrile
CID 140907096
N-(4-bromo-3-methylphenyl)-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
CID 22431862
4-methyl-2H-[1,2,4]triazolo[4,3-a]quinoline-1-thione
CID 19837109
4-chloro-6-methoxy-1-methyl-[1,2,4]triazolo[4,3-a]quinoxaline
CID 135276051
4-[(E)-2-(4-fluorophenyl)ethenyl]-1-methyl-[1,2,4]triazolo[4,3-a]quinoxaline
CID 42599460
[4-(4-hydroxyanilino)-1-methyl-[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]-phenylmethanone
CID 135550931

Frequently Asked Questions

What is the IUPAC name of 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol?
The IUPAC name of 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol (CID 123586465) is 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol.
What is the SMILES notation for 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol?
The canonical SMILES for 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol is Cc1nnc2c(O)cc3ccccc3n12.
What is the InChIKey of 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol?
The InChIKey is VXGXGSKNYMWHSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O/c1-7-12-13-11-10(15)6-8-4-2-3-5-9(8)14(7)11/h2-6,15H,1H3.
What are the key properties of 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol?
1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol has a molecular weight of 199.21 g/mol, XLogP of 1.90, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-[1,2,4]triazolo[4,3-a]quinolin-4-ol is sourced from PubChem (CID 123586465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).