2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide

C17H19NO3 — CID 70378439

IUPAC2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide
SMILESO=C(NCCc1ccccc1)C(O)C(O)c1ccccc1
InChIInChI=1S/C17H19NO3/c19-15(14-9-5-2-6-10-14)16(20)17(21)18-12-11-13-7-3-1-4-8-13/h1-10,15-16,19-20H,11-12H2,(H,18,21)
InChIKeyBXCFCVVLKIBDIH-UHFFFAOYSA-N
MW285.34 g/mol
LogP1.44
Rot. Bonds6

About 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide

2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide (PubChem CID 70378439) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound Name2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide
PubChem CID70378439
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide
SMILESO=C(NCCc1ccccc1)C(O)C(O)c1ccccc1
InChIInChI=1S/C17H19NO3/c19-15(14-9-5-2-6-10-14)16(20)17(21)18-12-11-13-7-3-1-4-8-13/h1-10,15-16,19-20H,11-12H2,(H,18,21)
InChIKeyBXCFCVVLKIBDIH-UHFFFAOYSA-N
XLogP1.44
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide?
The IUPAC name of 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide (CID 70378439) is 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide.
What is the SMILES notation for 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide?
The canonical SMILES for 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide is O=C(NCCc1ccccc1)C(O)C(O)c1ccccc1.
What is the InChIKey of 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide?
The InChIKey is BXCFCVVLKIBDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c19-15(14-9-5-2-6-10-14)16(20)17(21)18-12-11-13-7-3-1-4-8-13/h1-10,15-16,19-20H,11-12H2,(H,18,21).
What are the key properties of 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide?
2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide has a molecular weight of 285.34 g/mol, XLogP of 1.44, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-3-phenyl-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 70378439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).