(2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine

C14H29NO — CID 129065857

IUPAC(2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine
SMILESCCC(C)[C@@]1(C(C)C)O[C@H](C)CN1C(C)C
InChIInChI=1S/C14H29NO/c1-8-12(6)14(10(2)3)15(11(4)5)9-13(7)16-14/h10-13H,8-9H2,1-7H3/t12?,13-,14-/m1/s1
InChIKeyMEANFYJLNKEODQ-ILMHWDKJSA-N
MW227.39 g/mol
LogP3.51
Rot. Bonds4

About (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine

(2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine (PubChem CID 129065857) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name(2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine
PubChem CID129065857
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name(2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine
SMILESCCC(C)[C@@]1(C(C)C)O[C@H](C)CN1C(C)C
InChIInChI=1S/C14H29NO/c1-8-12(6)14(10(2)3)15(11(4)5)9-13(7)16-14/h10-13H,8-9H2,1-7H3/t12?,13-,14-/m1/s1
InChIKeyMEANFYJLNKEODQ-ILMHWDKJSA-N
XLogP3.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine?
The IUPAC name of (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine (CID 129065857) is (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine.
What is the SMILES notation for (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine?
The canonical SMILES for (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine is CCC(C)[C@@]1(C(C)C)O[C@H](C)CN1C(C)C.
What is the InChIKey of (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine?
The InChIKey is MEANFYJLNKEODQ-ILMHWDKJSA-N. The full InChI is InChI=1S/C14H29NO/c1-8-12(6)14(10(2)3)15(11(4)5)9-13(7)16-14/h10-13H,8-9H2,1-7H3/t12?,13-,14-/m1/s1.
What are the key properties of (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine?
(2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine has a molecular weight of 227.39 g/mol, XLogP of 3.51, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2-butan-2-yl-5-methyl-2,3-di(propan-2-yl)-1,3-oxazolidine is sourced from PubChem (CID 129065857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).