(4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole

C18H30N2O2 — CID 170900029

IUPAC(4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole
SMILESCC(C)=C(C1=N[C@H](C(C)(C)C)CO1)C1=N[C@H](C(C)(C)C)CO1
InChIInChI=1S/C18H30N2O2/c1-11(2)14(15-19-12(9-21-15)17(3,4)5)16-20-13(10-22-16)18(6,7)8/h12-13H,9-10H2,1-8H3/t12-,13-/m0/s1
InChIKeyBPGZELRRQZMRAR-STQMWFEESA-N
MW306.45 g/mol
LogP4.01
Rot. Bonds2

About (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole

(4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole (PubChem CID 170900029) has the molecular formula C18H30N2O2 and a molecular weight of 306.45 g/mol. Its IUPAC name is (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole.

Molecular Properties

Compound Name(4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole
PubChem CID170900029
Molecular FormulaC18H30N2O2
Molecular Weight306.45 g/mol
Exact Mass306.23
IUPAC Name(4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole
SMILESCC(C)=C(C1=N[C@H](C(C)(C)C)CO1)C1=N[C@H](C(C)(C)C)CO1
InChIInChI=1S/C18H30N2O2/c1-11(2)14(15-19-12(9-21-15)17(3,4)5)16-20-13(10-22-16)18(6,7)8/h12-13H,9-10H2,1-8H3/t12-,13-/m0/s1
InChIKeyBPGZELRRQZMRAR-STQMWFEESA-N
XLogP4.01
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.45
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole?
The IUPAC name of (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole (CID 170900029) is (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole.
What is the SMILES notation for (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole?
The canonical SMILES for (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole is CC(C)=C(C1=N[C@H](C(C)(C)C)CO1)C1=N[C@H](C(C)(C)C)CO1.
What is the InChIKey of (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole?
The InChIKey is BPGZELRRQZMRAR-STQMWFEESA-N. The full InChI is InChI=1S/C18H30N2O2/c1-11(2)14(15-19-12(9-21-15)17(3,4)5)16-20-13(10-22-16)18(6,7)8/h12-13H,9-10H2,1-8H3/t12-,13-/m0/s1.
What are the key properties of (4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole?
(4R)-4-tert-butyl-2-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole has a molecular weight of 306.45 g/mol, XLogP of 4.01, 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-[1-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]-2-methylprop-1-enyl]-4,5-dihydro-1,3-oxazole is sourced from PubChem (CID 170900029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).