N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide

C18H21NO2 — CID 14406199

IUPACN-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide
SMILESO=C(CCCc1ccccc1)N(O)CCc1ccccc1
InChIInChI=1S/C18H21NO2/c20-18(13-7-12-16-8-3-1-4-9-16)19(21)15-14-17-10-5-2-6-11-17/h1-6,8-11,21H,7,12-15H2
InChIKeySFUOMWLKDAEHOO-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.47
Rot. Bonds7

About N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide

N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide (PubChem CID 14406199) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide.

Molecular Properties

Compound NameN-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide
PubChem CID14406199
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide
SMILESO=C(CCCc1ccccc1)N(O)CCc1ccccc1
InChIInChI=1S/C18H21NO2/c20-18(13-7-12-16-8-3-1-4-9-16)19(21)15-14-17-10-5-2-6-11-17/h1-6,8-11,21H,7,12-15H2
InChIKeySFUOMWLKDAEHOO-UHFFFAOYSA-N
XLogP3.47
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide?
The IUPAC name of N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide (CID 14406199) is N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide.
What is the SMILES notation for N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide?
The canonical SMILES for N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide is O=C(CCCc1ccccc1)N(O)CCc1ccccc1.
What is the InChIKey of N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide?
The InChIKey is SFUOMWLKDAEHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c20-18(13-7-12-16-8-3-1-4-9-16)19(21)15-14-17-10-5-2-6-11-17/h1-6,8-11,21H,7,12-15H2.
What are the key properties of N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide?
N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide has a molecular weight of 283.37 g/mol, XLogP of 3.47, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-phenyl-N-(2-phenylethyl)butanamide is sourced from PubChem (CID 14406199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).