8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine

C12H10N4OS — CID 65209502

IUPAC8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine
SMILESCc1nnc(Oc2ccc(N)c3cccnc23)s1
InChIInChI=1S/C12H10N4OS/c1-7-15-16-12(18-7)17-10-5-4-9(13)8-3-2-6-14-11(8)10/h2-6H,13H2,1H3
InChIKeyDGRQCNPQDXZTBT-UHFFFAOYSA-N
MW258.31 g/mol
LogP2.77
Rot. Bonds2

About 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine

8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine (PubChem CID 65209502) has the molecular formula C12H10N4OS and a molecular weight of 258.31 g/mol. Its IUPAC name is 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine.

Molecular Properties

Compound Name8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine
PubChem CID65209502
Molecular FormulaC12H10N4OS
Molecular Weight258.31 g/mol
Exact Mass258.06
IUPAC Name8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine
SMILESCc1nnc(Oc2ccc(N)c3cccnc23)s1
InChIInChI=1S/C12H10N4OS/c1-7-15-16-12(18-7)17-10-5-4-9(13)8-3-2-6-14-11(8)10/h2-6H,13H2,1H3
InChIKeyDGRQCNPQDXZTBT-UHFFFAOYSA-N
XLogP2.77
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

8-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]quinolin-5-amine
CID 65274127
8-(4-methylpyrimidin-2-yl)oxyquinolin-5-amine
CID 62960007
8-[(3-chloro-4-pyridinyl)oxy]quinolin-5-amine
CID 79840623
8-[(5-methyl-2-pyridinyl)oxy]quinolin-5-amine
CID 60864239
8-(2-fluoro-5-methylphenoxy)quinolin-5-amine
CID 64855173
8-(4-chlorophenoxy)quinolin-5-amine
CID 43450277
8-(3,5-dichlorophenoxy)quinolin-5-amine
CID 43621813
8-(2,3-dichlorophenoxy)quinolin-5-amine
CID 43450313
5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine
CID 116525595
3-(5-aminoquinolin-8-yl)oxy-2-methylpropanamide
CID 60863326
8-(cyclopropylmethoxy)quinolin-5-amine
CID 43450315
8-cyclopropyloxyquinolin-5-amine
CID 156698468

Frequently Asked Questions

What is the IUPAC name of 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine?
The IUPAC name of 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine (CID 65209502) is 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine.
What is the SMILES notation for 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine?
The canonical SMILES for 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine is Cc1nnc(Oc2ccc(N)c3cccnc23)s1.
What is the InChIKey of 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine?
The InChIKey is DGRQCNPQDXZTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4OS/c1-7-15-16-12(18-7)17-10-5-4-9(13)8-3-2-6-14-11(8)10/h2-6H,13H2,1H3.
What are the key properties of 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine?
8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine has a molecular weight of 258.31 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(5-methyl-1,3,4-thiadiazol-2-yl)oxy]quinolin-5-amine is sourced from PubChem (CID 65209502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).