2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-5-fluoropyridine

2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-5-fluoropyridine

CAS: 2068819-66-7

Formula: C12H15FN2O

SMILES: CC(C)(C)[C@H]1COC(=N1)C1=CC=C(F)C=N1

IUPAC: 2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-5-fluoropyridine

InChI: InChI=1S/C12H15FN2O/c1-12(2,3)10-7-16-11(15-10)9-5-4-8(13)6-14-9/h4-6,10H,7H2,1-3H3/t10-/m1/s1

Composition: C (64.85%), H (6.80%), F (8.55%), N (12.60%), O (7.20%)

Molar Mass: 222.263

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	222.116841274
Formal Charge	0
FSP3	0.5
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	YVULGYITAFNKKF-SNVBAGLBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.84
Topological Polar Surface Area	34.48
Polarizability	22.68
Ring Count	2
Rotatable Bond Count	2

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