4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine

C10H13F3N2O2 — CID 83959744

IUPAC4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
SMILESCc1c(C(F)(F)F)noc1CN1CCOCC1
InChIInChI=1S/C10H13F3N2O2/c1-7-8(6-15-2-4-16-5-3-15)17-14-9(7)10(11,12)13/h2-6H2,1H3
InChIKeyNWYWIGUBWXXUTD-UHFFFAOYSA-N
MW250.22 g/mol
LogP1.83
Rot. Bonds2

About 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine

4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine (PubChem CID 83959744) has the molecular formula C10H13F3N2O2 and a molecular weight of 250.22 g/mol. Its IUPAC name is 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
PubChem CID83959744
Molecular FormulaC10H13F3N2O2
Molecular Weight250.22 g/mol
Exact Mass250.09
IUPAC Name4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
SMILESCc1c(C(F)(F)F)noc1CN1CCOCC1
InChIInChI=1S/C10H13F3N2O2/c1-7-8(6-15-2-4-16-5-3-15)17-14-9(7)10(11,12)13/h2-6H2,1H3
InChIKeyNWYWIGUBWXXUTD-UHFFFAOYSA-N
XLogP1.83
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.22
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-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

Related Compounds

4-[[4-ethyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine
CID 83959756
4-[[1-propan-2-yl-3-(trifluoromethyl)pyrazol-4-yl]methyl]morpholine
CID 129128460
4-[[4-tert-butyl-2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]morpholine
CID 83959702
2-(morpholin-4-ylmethyl)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid
CID 82227476
N-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]propan-1-amine
CID 83959748
4-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methyl]morpholine
CID 20785846
4-[(3,5-difluoro-4-methylphenyl)methyl]morpholine
CID 178059917
ethane;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine
CID 144816585
5-methyl-2-[4-(morpholin-4-ylmethyl)phenyl]-4-(trifluoromethyl)-1H-pyrimidin-6-one;2,2,2-trifluoroacetic acid
CID 154924744
4-[[3-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl]morpholine chloride
CID 45108699
2-[5-(morpholin-4-ylmethyl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 54857179
4-[(1,3-dimethylpyrazol-4-yl)methyl]morpholine
CID 126855039

Frequently Asked Questions

What is the IUPAC name of 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
The IUPAC name of 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine (CID 83959744) is 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine.
What is the SMILES notation for 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
The canonical SMILES for 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine is Cc1c(C(F)(F)F)noc1CN1CCOCC1.
What is the InChIKey of 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
The InChIKey is NWYWIGUBWXXUTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2O2/c1-7-8(6-15-2-4-16-5-3-15)17-14-9(7)10(11,12)13/h2-6H2,1H3.
What are the key properties of 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine?
4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine has a molecular weight of 250.22 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-methyl-3-(trifluoromethyl)-1,2-oxazol-5-yl]methyl]morpholine is sourced from PubChem (CID 83959744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).