2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide

C16H23NO2 — CID 928210

IUPAC2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide
SMILESCC(C)[C@H]1C[C@](CC(N)=O)(c2ccccc2)CCO1
InChIInChI=1S/C16H23NO2/c1-12(2)14-10-16(8-9-19-14,11-15(17)18)13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3,(H2,17,18)/t14-,16-/m1/s1
InChIKeyOJPJSOVOOAYROD-GDBMZVCRSA-N
MW261.36 g/mol
LogP2.63
Rot. Bonds4

About 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide

2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide (PubChem CID 928210) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide.

Molecular Properties

Compound Name2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide
PubChem CID928210
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide
SMILESCC(C)[C@H]1C[C@](CC(N)=O)(c2ccccc2)CCO1
InChIInChI=1S/C16H23NO2/c1-12(2)14-10-16(8-9-19-14,11-15(17)18)13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3,(H2,17,18)/t14-,16-/m1/s1
InChIKeyOJPJSOVOOAYROD-GDBMZVCRSA-N
XLogP2.63
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide?
The IUPAC name of 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide (CID 928210) is 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide.
What is the SMILES notation for 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide?
The canonical SMILES for 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide is CC(C)[C@H]1C[C@](CC(N)=O)(c2ccccc2)CCO1.
What is the InChIKey of 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide?
The InChIKey is OJPJSOVOOAYROD-GDBMZVCRSA-N. The full InChI is InChI=1S/C16H23NO2/c1-12(2)14-10-16(8-9-19-14,11-15(17)18)13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3,(H2,17,18)/t14-,16-/m1/s1.
What are the key properties of 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide?
2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide has a molecular weight of 261.36 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,4R)-4-phenyl-2-propan-2-yloxan-4-yl]acetamide is sourced from PubChem (CID 928210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).