N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine

C20H20N4O3 — CID 15953921

IUPACN-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine
SMILESc1ccc(C(=NOCc2nnc(N3CCOCC3)o2)c2ccccc2)cc1
InChIInChI=1S/C20H20N4O3/c1-3-7-16(8-4-1)19(17-9-5-2-6-10-17)23-26-15-18-21-22-20(27-18)24-11-13-25-14-12-24/h1-10H,11-15H2
InChIKeyUHSSXNAXEOYWBT-UHFFFAOYSA-N
MW364.40 g/mol
LogP2.88
Rot. Bonds6

About N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine

N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine (PubChem CID 15953921) has the molecular formula C20H20N4O3 and a molecular weight of 364.40 g/mol. Its IUPAC name is N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine
PubChem CID15953921
Molecular FormulaC20H20N4O3
Molecular Weight364.40 g/mol
Exact Mass364.15
IUPAC NameN-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine
SMILESc1ccc(C(=NOCc2nnc(N3CCOCC3)o2)c2ccccc2)cc1
InChIInChI=1S/C20H20N4O3/c1-3-7-16(8-4-1)19(17-9-5-2-6-10-17)23-26-15-18-21-22-20(27-18)24-11-13-25-14-12-24/h1-10H,11-15H2
InChIKeyUHSSXNAXEOYWBT-UHFFFAOYSA-N
XLogP2.88
TPSA72.98 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine?
The IUPAC name of N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine (CID 15953921) is N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine.
What is the SMILES notation for N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine?
The canonical SMILES for N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine is c1ccc(C(=NOCc2nnc(N3CCOCC3)o2)c2ccccc2)cc1.
What is the InChIKey of N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine?
The InChIKey is UHSSXNAXEOYWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-3-7-16(8-4-1)19(17-9-5-2-6-10-17)23-26-15-18-21-22-20(27-18)24-11-13-25-14-12-24/h1-10H,11-15H2.
What are the key properties of N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine?
N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine has a molecular weight of 364.40 g/mol, XLogP of 2.88, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-morpholin-4-yl-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenylmethanimine is sourced from PubChem (CID 15953921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).