4-[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]benzaldehyde

4-[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]benzaldehyde

CAS: 1119450-76-8

Formula: C14H15N3O3

SMILES: O=CC1=CC=C(C=C1)C1=NOC(CN2CCOCC2)=N1

IUPAC: 4-{5-[(morpholin-4-yl)methyl]-1,2,4-oxadiazol-3-yl}benzaldehyde

InChI: InChI=1S/C14H15N3O3/c18-10-11-1-3-12(4-2-11)14-15-13(20-16-14)9-17-5-7-19-8-6-17/h1-4,10H,5-9H2

Composition: C (61.53%), H (5.53%), N (15.38%), O (17.56%)

Molar Mass: 273.292

Atom Count: 35

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	273.111341355
Formal Charge	0
FSP3	0.36
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	KXPWUBCJSOFXFS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.61
Topological Polar Surface Area	68.46
Polarizability	28.32
Ring Count	3
Rotatable Bond Count	4

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