1-[4-(1,3-Benzoxazol-2-yl)-2-methoxyphenyl]cyclobutanecarbonitrile

HCID 21990946
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Basic information

Standard SMILES
COc1cc(-c2nc3ccccc3o2)ccc1C1(C#N)CCC1
InChIKey
PTABSUQTJWMZTM-UHFFFAOYSA-N
Molecular formula
C19H16N2O2
Average molar mass
304.3 g/mol

Names & identifiers

Preferred name
1-[4-(1,3-Benzoxazol-2-yl)-2-methoxyphenyl]cyclobutanecarbonitrile
IUPAC
1-[4-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]cyclobutane-1-carbonitrile

Names & synonyms

SCHEMBL5832377PTABSUQTJWMZTM-UHFFFAOYSA-N1-[4-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]cyclobutanecarbonitrile

Database identifiers

PubChem CID
21990946

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
59.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
23

Related reactions

2 records
New reaction record

Compound notes

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