2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide

C19H23NO2 — CID 11243450

IUPAC2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide
SMILESCCC(O)(C(=O)NCCCc1ccccc1)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-2-19(22,17-13-7-4-8-14-17)18(21)20-15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14,22H,2,9,12,15H2,1H3,(H,20,21)
InChIKeyUVODUPXBCSTHLJ-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.03
Rot. Bonds7

About 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide

2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide (PubChem CID 11243450) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide.

Molecular Properties

Compound Name2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide
PubChem CID11243450
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide
SMILESCCC(O)(C(=O)NCCCc1ccccc1)c1ccccc1
InChIInChI=1S/C19H23NO2/c1-2-19(22,17-13-7-4-8-14-17)18(21)20-15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14,22H,2,9,12,15H2,1H3,(H,20,21)
InChIKeyUVODUPXBCSTHLJ-UHFFFAOYSA-N
XLogP3.03
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide?
The IUPAC name of 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide (CID 11243450) is 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide.
What is the SMILES notation for 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide?
The canonical SMILES for 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide is CCC(O)(C(=O)NCCCc1ccccc1)c1ccccc1.
What is the InChIKey of 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide?
The InChIKey is UVODUPXBCSTHLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-19(22,17-13-7-4-8-14-17)18(21)20-15-9-12-16-10-5-3-6-11-16/h3-8,10-11,13-14,22H,2,9,12,15H2,1H3,(H,20,21).
What are the key properties of 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide?
2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide has a molecular weight of 297.40 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-phenyl-N-(3-phenylpropyl)butanamide is sourced from PubChem (CID 11243450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).