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

C5H5F3N2O — CID 130054794

IUPAC2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine
SMILESCc1nc(C(F)(F)F)c(N)o1
InChIInChI=1S/C5H5F3N2O/c1-2-10-3(4(9)11-2)5(6,7)8/h9H2,1H3
InChIKeyPATCPNPIPPXGNR-UHFFFAOYSA-N
MW166.10 g/mol
LogP1.58
Rot. Bonds

About 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine

2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine (PubChem CID 130054794) has the molecular formula C5H5F3N2O and a molecular weight of 166.10 g/mol. Its IUPAC name is 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine.

Molecular Properties

Compound Name2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine
PubChem CID130054794
Molecular FormulaC5H5F3N2O
Molecular Weight166.10 g/mol
Exact Mass166.04
IUPAC Name2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine
SMILESCc1nc(C(F)(F)F)c(N)o1
InChIInChI=1S/C5H5F3N2O/c1-2-10-3(4(9)11-2)5(6,7)8/h9H2,1H3
InChIKeyPATCPNPIPPXGNR-UHFFFAOYSA-N
XLogP1.58
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.10
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(trifluoromethyl)-1,3-oxazole-2,5-diamine
CID 69333844
5-propan-2-yl-4-(trifluoromethyl)-1,3-oxazol-2-amine
CID 105447786
2-methyl-4-propan-2-yl-5-(trifluoromethyl)-1,3-oxazole
CID 59459038
2-methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)-1,3-oxazol-5-amine
CID 66486222
N,2-dimethyl-5-(trifluoromethyl)-1,3-oxazol-4-amine
CID 154012170
3-(difluoromethyl)-5-methyl-6-(trifluoromethyl)pyridin-2-amine
CID 119019045
1-(5-amino-2-methyl-1,3-oxazol-4-yl)cyclopropan-1-ol
CID 168788254
3,4,6-trimethyl-5-(trifluoromethyl)pyridin-2-amine
CID 176974728
5-tert-butyl-2-ethyl-4-methyl-1,3-oxazole;4-tert-butyl-2-methyl-5-(trifluoromethyl)-1,3-oxazole
CID 161246247
4,6-dimethyl-5-(trifluoromethyl)pyrimidin-2-amine
CID 177041669
5-fluoro-2-(1,1,2,2,2-pentafluoroethyl)-4-(trifluoromethyl)-1,3-oxazole
CID 14494661
5-methyl-3-(trifluoromethyl)-1H-pyrazol-4-amine;hydrochloride
CID 165431141

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine?
The IUPAC name of 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine (CID 130054794) is 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine.
What is the SMILES notation for 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine?
The canonical SMILES for 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine is Cc1nc(C(F)(F)F)c(N)o1.
What is the InChIKey of 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine?
The InChIKey is PATCPNPIPPXGNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F3N2O/c1-2-10-3(4(9)11-2)5(6,7)8/h9H2,1H3.
What are the key properties of 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine?
2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine has a molecular weight of 166.10 g/mol, XLogP of 1.58, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(trifluoromethyl)-1,3-oxazol-5-amine is sourced from PubChem (CID 130054794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).