(4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole

C19H34N2O2 — CID 18345540

IUPAC(4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole
SMILESCC(C)(C)[C@H]1N=C(CC2=N[C@H](C(C)(C)C)C(C)(C)O2)OC1(C)C
InChIInChI=1S/C19H34N2O2/c1-16(2,3)14-18(7,8)22-12(20-14)11-13-21-15(17(4,5)6)19(9,10)23-13/h14-15H,11H2,1-10H3/t14-,15-/m1/s1
InChIKeyYGJWAZPTBNROJX-HUUCEWRRSA-N
MW322.49 g/mol
LogP4.62
Rot. Bonds2

About (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole

(4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole (PubChem CID 18345540) has the molecular formula C19H34N2O2 and a molecular weight of 322.49 g/mol. Its IUPAC name is (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole.

Molecular Properties

Compound Name(4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole
PubChem CID18345540
Molecular FormulaC19H34N2O2
Molecular Weight322.49 g/mol
Exact Mass322.26
IUPAC Name(4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole
SMILESCC(C)(C)[C@H]1N=C(CC2=N[C@H](C(C)(C)C)C(C)(C)O2)OC1(C)C
InChIInChI=1S/C19H34N2O2/c1-16(2,3)14-18(7,8)22-12(20-14)11-13-21-15(17(4,5)6)19(9,10)23-13/h14-15H,11H2,1-10H3/t14-,15-/m1/s1
InChIKeyYGJWAZPTBNROJX-HUUCEWRRSA-N
XLogP4.62
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.49
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole?
The IUPAC name of (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole (CID 18345540) is (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole.
What is the SMILES notation for (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole?
The canonical SMILES for (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole is CC(C)(C)[C@H]1N=C(CC2=N[C@H](C(C)(C)C)C(C)(C)O2)OC1(C)C.
What is the InChIKey of (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole?
The InChIKey is YGJWAZPTBNROJX-HUUCEWRRSA-N. The full InChI is InChI=1S/C19H34N2O2/c1-16(2,3)14-18(7,8)22-12(20-14)11-13-21-15(17(4,5)6)19(9,10)23-13/h14-15H,11H2,1-10H3/t14-,15-/m1/s1.
What are the key properties of (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole?
(4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole has a molecular weight of 322.49 g/mol, XLogP of 4.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-tert-butyl-2-[[(4R)-4-tert-butyl-5,5-dimethyl-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4H-1,3-oxazole is sourced from PubChem (CID 18345540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).