4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine

C11H9F3N2O2 — CID 90706867

IUPAC4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
SMILESCOc1c(-c2coc(N)n2)cccc1C(F)(F)F
InChIInChI=1S/C11H9F3N2O2/c1-17-9-6(8-5-18-10(15)16-8)3-2-4-7(9)11(12,13)14/h2-5H,1H3,(H2,15,16)
InChIKeyNGUMLJJDSFYSAQ-UHFFFAOYSA-N
MW258.20 g/mol
LogP2.95
Rot. Bonds2

About 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine

4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine (PubChem CID 90706867) has the molecular formula C11H9F3N2O2 and a molecular weight of 258.20 g/mol. Its IUPAC name is 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine.

Molecular Properties

Compound Name4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
PubChem CID90706867
Molecular FormulaC11H9F3N2O2
Molecular Weight258.20 g/mol
Exact Mass258.06
IUPAC Name4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
SMILESCOc1c(-c2coc(N)n2)cccc1C(F)(F)F
InChIInChI=1S/C11H9F3N2O2/c1-17-9-6(8-5-18-10(15)16-8)3-2-4-7(9)11(12,13)14/h2-5H,1H3,(H2,15,16)
InChIKeyNGUMLJJDSFYSAQ-UHFFFAOYSA-N
XLogP2.95
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.20
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine 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

5-[3-(1,1-difluoroethyl)-2-methoxyphenyl]-1,2-oxazol-3-amine
CID 117388330
4-methoxy-2,6-bis[2-(trifluoromethyl)phenyl]pyridine
CID 134618215
2-[2-methoxy-3-(trifluoromethyl)phenyl]-6-methyl-1H-pyridin-4-one
CID 169249883
8-(2-amino-1,3-oxazol-4-yl)naphthalene-2-carbonitrile;4-(7-bromonaphthalen-1-yl)-1,3-oxazol-2-amine
CID 159282692
[2-methoxy-3-(trifluoromethyl)phenyl]-pyridin-4-ylmethanone
CID 134627443
4-methoxy-5-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]pyridine
CID 134628438
3-(3-tert-butyl-2-methoxyphenyl)-1-(2,2,2-trifluoroethyl)pyrazole
CID 129167944
methyl 6-[2-fluoro-3-methoxy-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate
CID 150262040
3-[2-methoxy-6-(trifluoromethyl)phenyl]-1,2-oxazol-5-amine
CID 117398617
(3S,4S,5R)-3-[2-methoxy-3-(trifluoromethyl)phenyl]-4,5-dimethyl-5-(trifluoromethyl)oxolan-2-ol
CID 166159855
4-methoxy-3,5-bis(trifluoromethyl)aniline
CID 134640581
5-(trifluoromethyl)quinazolin-2-amine
CID 10488765

Frequently Asked Questions

What is the IUPAC name of 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The IUPAC name of 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine (CID 90706867) is 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine.
What is the SMILES notation for 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The canonical SMILES for 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine is COc1c(-c2coc(N)n2)cccc1C(F)(F)F.
What is the InChIKey of 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The InChIKey is NGUMLJJDSFYSAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2O2/c1-17-9-6(8-5-18-10(15)16-8)3-2-4-7(9)11(12,13)14/h2-5H,1H3,(H2,15,16).
What are the key properties of 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine has a molecular weight of 258.20 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methoxy-3-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine is sourced from PubChem (CID 90706867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).