2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine

C20H23N3O3 — CID 138029767

IUPAC2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
SMILESCOCC1(C)CN(Cc2nnc(-c3cccc4ccccc34)o2)CCO1
InChIInChI=1S/C20H23N3O3/c1-20(14-24-2)13-23(10-11-25-20)12-18-21-22-19(26-18)17-9-5-7-15-6-3-4-8-16(15)17/h3-9H,10-14H2,1-2H3
InChIKeyIRCGFALFAIGQHG-UHFFFAOYSA-N
MW353.42 g/mol
LogP3.13
Rot. Bonds5

About 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine

2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine (PubChem CID 138029767) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine.

Molecular Properties

Compound Name2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
PubChem CID138029767
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine
SMILESCOCC1(C)CN(Cc2nnc(-c3cccc4ccccc34)o2)CCO1
InChIInChI=1S/C20H23N3O3/c1-20(14-24-2)13-23(10-11-25-20)12-18-21-22-19(26-18)17-9-5-7-15-6-3-4-8-16(15)17/h3-9H,10-14H2,1-2H3
InChIKeyIRCGFALFAIGQHG-UHFFFAOYSA-N
XLogP3.13
TPSA60.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
The IUPAC name of 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine (CID 138029767) is 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine.
What is the SMILES notation for 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
The canonical SMILES for 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine is COCC1(C)CN(Cc2nnc(-c3cccc4ccccc34)o2)CCO1.
What is the InChIKey of 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
The InChIKey is IRCGFALFAIGQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O3/c1-20(14-24-2)13-23(10-11-25-20)12-18-21-22-19(26-18)17-9-5-7-15-6-3-4-8-16(15)17/h3-9H,10-14H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine?
2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine has a molecular weight of 353.42 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-2-methyl-4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)methyl]morpholine is sourced from PubChem (CID 138029767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).