(4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine

C10H10F2N2O — CID 59323712

IUPAC(4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine
SMILESC[C@]1(c2cc(F)ccc2F)COC(N)=N1
InChIInChI=1S/C10H10F2N2O/c1-10(5-15-9(13)14-10)7-4-6(11)2-3-8(7)12/h2-4H,5H2,1H3,(H2,13,14)/t10-/m1/s1
InChIKeyTYMMYMILCDGLGY-SNVBAGLBSA-N
MW212.20 g/mol
LogP1.52
Rot. Bonds1

About (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine

(4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine (PubChem CID 59323712) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine.

Molecular Properties

Compound Name(4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine
PubChem CID59323712
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name(4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine
SMILESC[C@]1(c2cc(F)ccc2F)COC(N)=N1
InChIInChI=1S/C10H10F2N2O/c1-10(5-15-9(13)14-10)7-4-6(11)2-3-8(7)12/h2-4H,5H2,1H3,(H2,13,14)/t10-/m1/s1
InChIKeyTYMMYMILCDGLGY-SNVBAGLBSA-N
XLogP1.52
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-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

Frequently Asked Questions

What is the IUPAC name of (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine?
The IUPAC name of (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine (CID 59323712) is (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine.
What is the SMILES notation for (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine?
The canonical SMILES for (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine is C[C@]1(c2cc(F)ccc2F)COC(N)=N1.
What is the InChIKey of (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine?
The InChIKey is TYMMYMILCDGLGY-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H10F2N2O/c1-10(5-15-9(13)14-10)7-4-6(11)2-3-8(7)12/h2-4H,5H2,1H3,(H2,13,14)/t10-/m1/s1.
What are the key properties of (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine?
(4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine has a molecular weight of 212.20 g/mol, XLogP of 1.52, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(2,5-difluorophenyl)-4-methyl-5H-1,3-oxazol-2-amine is sourced from PubChem (CID 59323712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).