(2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide

C14H21NO2 — CID 11322291

IUPAC(2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCONC(=O)[C@H](C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-17-4/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1
InChIKeyUOURTTOYLTUYKY-LLVKDONJSA-N
MW235.33 g/mol
LogP2.67
Rot. Bonds5

About (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide

(2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide (PubChem CID 11322291) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide.

Molecular Properties

Compound Name(2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide
PubChem CID11322291
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name(2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCONC(=O)[C@H](C)c1ccc(CC(C)C)cc1
InChIInChI=1S/C14H21NO2/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-17-4/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1
InChIKeyUOURTTOYLTUYKY-LLVKDONJSA-N
XLogP2.67
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide 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 (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide?
The IUPAC name of (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide (CID 11322291) is (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide.
What is the SMILES notation for (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide?
The canonical SMILES for (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide is CONC(=O)[C@H](C)c1ccc(CC(C)C)cc1.
What is the InChIKey of (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide?
The InChIKey is UOURTTOYLTUYKY-LLVKDONJSA-N. The full InChI is InChI=1S/C14H21NO2/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-17-4/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1.
What are the key properties of (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide?
(2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide has a molecular weight of 235.33 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methoxy-2-[4-(2-methylpropyl)phenyl]propanamide is sourced from PubChem (CID 11322291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).