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

C4H3F3N2O — CID 156595636

IUPAC2-(trifluoromethyl)-1,3-oxazol-4-amine
SMILESNc1coc(C(F)(F)F)n1
InChIInChI=1S/C4H3F3N2O/c5-4(6,7)3-9-2(8)1-10-3/h1H,8H2
InChIKeyWCNNFAMWJLDIGC-UHFFFAOYSA-N
MW152.08 g/mol
LogP1.28
Rot. Bonds

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

2-(trifluoromethyl)-1,3-oxazol-4-amine (PubChem CID 156595636) has the molecular formula C4H3F3N2O and a molecular weight of 152.08 g/mol. Its IUPAC name is 2-(trifluoromethyl)-1,3-oxazol-4-amine.

Molecular Properties

Compound Name2-(trifluoromethyl)-1,3-oxazol-4-amine
PubChem CID156595636
Molecular FormulaC4H3F3N2O
Molecular Weight152.08 g/mol
Exact Mass152.02
IUPAC Name2-(trifluoromethyl)-1,3-oxazol-4-amine
SMILESNc1coc(C(F)(F)F)n1
InChIInChI=1S/C4H3F3N2O/c5-4(6,7)3-9-2(8)1-10-3/h1H,8H2
InChIKeyWCNNFAMWJLDIGC-UHFFFAOYSA-N
XLogP1.28
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.08
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(trifluoromethyl)-1,3-oxazole-4-carboxylic acid
CID 67424422
2-[4-(trifluoromethyl)phenoxy]-1,3-oxazol-4-amine
CID 117188911
4-piperidin-4-yl-2-(trifluoromethyl)-1,3-oxazole
CID 84685359
[3-[2-(trifluoromethyl)-1,3-oxazol-4-yl]phenyl]methanamine
CID 115044579
2-methylsulfanyl-1,3-oxazol-4-amine
CID 117188944
(4-amino-1,3-oxazol-2-yl)methanethiol
CID 117186793
2-fluoro-5-[2-(trifluoromethyl)-1,3-oxazol-4-yl]benzoic acid
CID 115050945
2-(trifluoromethyl)-[1,3]oxazolo[5,4-d]pyrimidin-7-amine
CID 82396769
2-(methylsulfanylmethyl)-1,3-oxazol-4-amine
CID 117186769
[2-(aminomethyl)-1,4-oxazepan-4-yl]-[2-(trifluoromethyl)-1,3-oxazol-4-yl]methanone
CID 154768989
4-(3,5-dichlorophenyl)-2-(trifluoromethyl)-1,3-oxazol-5-amine
CID 21217091
1-[2-(1,1-difluoroethyl)-1,3-oxazol-4-yl]ethanone
CID 84766773

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-1,3-oxazol-4-amine?
The IUPAC name of 2-(trifluoromethyl)-1,3-oxazol-4-amine (CID 156595636) is 2-(trifluoromethyl)-1,3-oxazol-4-amine.
What is the SMILES notation for 2-(trifluoromethyl)-1,3-oxazol-4-amine?
The canonical SMILES for 2-(trifluoromethyl)-1,3-oxazol-4-amine is Nc1coc(C(F)(F)F)n1.
What is the InChIKey of 2-(trifluoromethyl)-1,3-oxazol-4-amine?
The InChIKey is WCNNFAMWJLDIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F3N2O/c5-4(6,7)3-9-2(8)1-10-3/h1H,8H2.
What are the key properties of 2-(trifluoromethyl)-1,3-oxazol-4-amine?
2-(trifluoromethyl)-1,3-oxazol-4-amine has a molecular weight of 152.08 g/mol, XLogP of 1.28, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-1,3-oxazol-4-amine is sourced from PubChem (CID 156595636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).