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7,7-dimethyl-N-(2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl)-5,6,7,8-tetrahydroquinoline-2-carboxamide

HCID 71087656
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1nc(C(C)(C)NC(=O)c2ccc3c(n2)CC(C)(C)CC3)no1
InChIKey
YGOJUHNGHSCKBP-UHFFFAOYSA-N
Molecular formula
C18H24N4O2
Average molar mass
328.4 g/mol

Names & identifiers

Preferred name
7,7-dimethyl-N-(2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl)-5,6,7,8-tetrahydroquinoline-2-carboxamide
IUPAC
7,7-dimethyl-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl]-6,8-dihydro-5H-quinoline-2-carboxamide

Names & synonyms

CHEMBL3936370SCHEMBL14152304YGOJUHNGHSCKBP-UHFFFAOYSA-NBDBM210410US9290451, 1447,7-dimethyl-N-(2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-yl)-5,6,7,8-tetrahydroquinoline-2-carboxamide

Database identifiers

PubChem CID
71087656
ChEMBL
CHEMBL3936370

Properties

Computed structural propertiesFilling in

XLogP
3.3
Topological polar surface area
80.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
24
Formal charge
0
Complexity
480

Related reactions

3 records
New reaction record
HRID 632190 reaction equation
HRID 632190As productuspto-grants-2016_04
HRID 927576 reaction equation
HRID 927576As productuspto-grants-2016_03
HRID 2132474 reaction equation
HRID 2132474As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes