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6-Methyl-2-phenyl-[1,2,4]triazolo[1,5-A]pyridin-7-amine

HCID 67775113
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1380331-26-9
Standard SMILES
Cc1cn2nc(-c3ccccc3)nc2cc1N
InChIKey
RULTYYNTZACCIP-UHFFFAOYSA-N
Molecular formula
C13H12N4
Average molar mass
224.26 g/mol
Monoisotopic mass
224.10619638

Names & identifiers

Preferred name
6-Methyl-2-phenyl-[1,2,4]triazolo[1,5-A]pyridin-7-amine
IUPAC
6-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-amine

Names & synonyms

1380331-26-96-METHYL-2-PHENYL-[1,2,4]TRIAZOLO[1,5-A]PYRIDIN-7-AMINESCHEMBL9106471DTXSID80737640RULTYYNTZACCIP-UHFFFAOYSA-N6-Methyl-2-phenyl[1,2,4]triazolo[1,5-a]pyridin-7-amine6-methyl-2-phenyl-[1,2,4]triazolo[1,5-a]pyridin-7-ylamine

Database identifiers

CAS
1380331-26-9
PubChem CID
67775113
DTXSID
DTXSID80737640

Properties

Computed structural propertiesFilling in

XLogP
2.1
Topological polar surface area
56.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
264

Related reactions

3 records
New reaction record
HRID 295124 reaction equation
HRID 295124As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 948347 reaction equation
HRID 948347As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1802159 reaction equation
HRID 1802159As productuspto-grants-2013_01

Compound notes

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