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

C19H34N2O2 — CID 18345489

IUPAC(4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole
SMILESCC(C)C[C@H]1N=C(CC2=N[C@H](CC(C)C)C(C)(C)O2)OC1(C)C
InChIInChI=1S/C19H34N2O2/c1-12(2)9-14-18(5,6)22-16(20-14)11-17-21-15(10-13(3)4)19(7,8)23-17/h12-15H,9-11H2,1-8H3/t14-,15-/m1/s1
InChIKeyYXBVACOURMOOOM-HUUCEWRRSA-N
MW322.49 g/mol
LogP4.62
Rot. Bonds6

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

(4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole (PubChem CID 18345489) has the molecular formula C19H34N2O2 and a molecular weight of 322.49 g/mol. Its IUPAC name is (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole.

Molecular Properties

Compound Name(4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole
PubChem CID18345489
Molecular FormulaC19H34N2O2
Molecular Weight322.49 g/mol
Exact Mass322.26
IUPAC Name(4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole
SMILESCC(C)C[C@H]1N=C(CC2=N[C@H](CC(C)C)C(C)(C)O2)OC1(C)C
InChIInChI=1S/C19H34N2O2/c1-12(2)9-14-18(5,6)22-16(20-14)11-17-21-15(10-13(3)4)19(7,8)23-17/h12-15H,9-11H2,1-8H3/t14-,15-/m1/s1
InChIKeyYXBVACOURMOOOM-HUUCEWRRSA-N
XLogP4.62
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
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)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole?
The IUPAC name of (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole (CID 18345489) is (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole.
What is the SMILES notation for (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole?
The canonical SMILES for (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole is CC(C)C[C@H]1N=C(CC2=N[C@H](CC(C)C)C(C)(C)O2)OC1(C)C.
What is the InChIKey of (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole?
The InChIKey is YXBVACOURMOOOM-HUUCEWRRSA-N. The full InChI is InChI=1S/C19H34N2O2/c1-12(2)9-14-18(5,6)22-16(20-14)11-17-21-15(10-13(3)4)19(7,8)23-17/h12-15H,9-11H2,1-8H3/t14-,15-/m1/s1.
What are the key properties of (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole?
(4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole has a molecular weight of 322.49 g/mol, XLogP of 4.62, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-[[(4R)-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazol-2-yl]methyl]-5,5-dimethyl-4-(2-methylpropyl)-4H-1,3-oxazole is sourced from PubChem (CID 18345489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).