N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide

C17H19NO4 — CID 70689467

IUPACN,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide
SMILESCC(CO)(OCc1ccc(-c2ccccc2)cc1)C(=O)NO
InChIInChI=1S/C17H19NO4/c1-17(12-19,16(20)18-21)22-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,19,21H,11-12H2,1H3,(H,18,20)
InChIKeyUSVYJEVSFXUUGQ-UHFFFAOYSA-N
MW301.34 g/mol
LogP2.13
Rot. Bonds6

About N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide

N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide (PubChem CID 70689467) has the molecular formula C17H19NO4 and a molecular weight of 301.34 g/mol. Its IUPAC name is N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide.

Molecular Properties

Compound NameN,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide
PubChem CID70689467
Molecular FormulaC17H19NO4
Molecular Weight301.34 g/mol
Exact Mass301.13
IUPAC NameN,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide
SMILESCC(CO)(OCc1ccc(-c2ccccc2)cc1)C(=O)NO
InChIInChI=1S/C17H19NO4/c1-17(12-19,16(20)18-21)22-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,19,21H,11-12H2,1H3,(H,18,20)
InChIKeyUSVYJEVSFXUUGQ-UHFFFAOYSA-N
XLogP2.13
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.34
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide?
The IUPAC name of N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide (CID 70689467) is N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide.
What is the SMILES notation for N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide?
The canonical SMILES for N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide is CC(CO)(OCc1ccc(-c2ccccc2)cc1)C(=O)NO.
What is the InChIKey of N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide?
The InChIKey is USVYJEVSFXUUGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO4/c1-17(12-19,16(20)18-21)22-11-13-7-9-15(10-8-13)14-5-3-2-4-6-14/h2-10,19,21H,11-12H2,1H3,(H,18,20).
What are the key properties of N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide?
N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide has a molecular weight of 301.34 g/mol, XLogP of 2.13, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dihydroxy-2-methyl-2-[(4-phenylphenyl)methoxy]propanamide is sourced from PubChem (CID 70689467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).