N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide

C11H13NO2 — CID 15399477

IUPACN-[(2R,3R)-2-phenyloxetan-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CO[C@@H]1c1ccccc1
InChIInChI=1S/C11H13NO2/c1-8(13)12-10-7-14-11(10)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)/t10-,11-/m1/s1
InChIKeyUBXZDXOBVPXQAK-GHMZBOCLSA-N
MW191.23 g/mol
LogP1.26
Rot. Bonds2

About N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide

N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide (PubChem CID 15399477) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2R,3R)-2-phenyloxetan-3-yl]acetamide
PubChem CID15399477
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC NameN-[(2R,3R)-2-phenyloxetan-3-yl]acetamide
SMILESCC(=O)N[C@@H]1CO[C@@H]1c1ccccc1
InChIInChI=1S/C11H13NO2/c1-8(13)12-10-7-14-11(10)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)/t10-,11-/m1/s1
InChIKeyUBXZDXOBVPXQAK-GHMZBOCLSA-N
XLogP1.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide?
The IUPAC name of N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide (CID 15399477) is N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide.
What is the SMILES notation for N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide?
The canonical SMILES for N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide is CC(=O)N[C@@H]1CO[C@@H]1c1ccccc1.
What is the InChIKey of N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide?
The InChIKey is UBXZDXOBVPXQAK-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H13NO2/c1-8(13)12-10-7-14-11(10)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)/t10-,11-/m1/s1.
What are the key properties of N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide?
N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide has a molecular weight of 191.23 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3R)-2-phenyloxetan-3-yl]acetamide is sourced from PubChem (CID 15399477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).