(4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one

C13H21NO2 — CID 150959274

IUPAC(4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one
SMILESCC(C)[C@@H]1COC(=O)N1C=CC1CCCC1
InChIInChI=1S/C13H21NO2/c1-10(2)12-9-16-13(15)14(12)8-7-11-5-3-4-6-11/h7-8,10-12H,3-6,9H2,1-2H3/t12-/m0/s1
InChIKeyLLTCHBPWJPLXGB-LBPRGKRZSA-N
MW223.32 g/mol
LogP3.17
Rot. Bonds3

About (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one

(4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one (PubChem CID 150959274) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one
PubChem CID150959274
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name(4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one
SMILESCC(C)[C@@H]1COC(=O)N1C=CC1CCCC1
InChIInChI=1S/C13H21NO2/c1-10(2)12-9-16-13(15)14(12)8-7-11-5-3-4-6-11/h7-8,10-12H,3-6,9H2,1-2H3/t12-/m0/s1
InChIKeyLLTCHBPWJPLXGB-LBPRGKRZSA-N
XLogP3.17
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one?
The IUPAC name of (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one (CID 150959274) is (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one?
The canonical SMILES for (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one is CC(C)[C@@H]1COC(=O)N1C=CC1CCCC1.
What is the InChIKey of (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one?
The InChIKey is LLTCHBPWJPLXGB-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H21NO2/c1-10(2)12-9-16-13(15)14(12)8-7-11-5-3-4-6-11/h7-8,10-12H,3-6,9H2,1-2H3/t12-/m0/s1.
What are the key properties of (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one?
(4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one has a molecular weight of 223.32 g/mol, XLogP of 3.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-(2-cyclopentylethenyl)-4-propan-2-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 150959274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).