[(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate

C10H19NO3 — CID 170075886

IUPAC[(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate
SMILESCCC(C)(C)NC(=O)O[C@@H]1CCOC1
InChIInChI=1S/C10H19NO3/c1-4-10(2,3)11-9(12)14-8-5-6-13-7-8/h8H,4-7H2,1-3H3,(H,11,12)/t8-/m1/s1
InChIKeyNEYSWGPXPFTPOY-MRVPVSSYSA-N
MW201.27 g/mol
LogP1.69
Rot. Bonds3

About [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate

[(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate (PubChem CID 170075886) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate.

Molecular Properties

Compound Name[(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate
PubChem CID170075886
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name[(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate
SMILESCCC(C)(C)NC(=O)O[C@@H]1CCOC1
InChIInChI=1S/C10H19NO3/c1-4-10(2,3)11-9(12)14-8-5-6-13-7-8/h8H,4-7H2,1-3H3,(H,11,12)/t8-/m1/s1
InChIKeyNEYSWGPXPFTPOY-MRVPVSSYSA-N
XLogP1.69
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate?
The IUPAC name of [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate (CID 170075886) is [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate.
What is the SMILES notation for [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate?
The canonical SMILES for [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate is CCC(C)(C)NC(=O)O[C@@H]1CCOC1.
What is the InChIKey of [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate?
The InChIKey is NEYSWGPXPFTPOY-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-4-10(2,3)11-9(12)14-8-5-6-13-7-8/h8H,4-7H2,1-3H3,(H,11,12)/t8-/m1/s1.
What are the key properties of [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate?
[(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate has a molecular weight of 201.27 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-oxolan-3-yl] N-(2-methylbutan-2-yl)carbamate is sourced from PubChem (CID 170075886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).