N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide

C12H17NO3 — CID 53315822

IUPACN-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1ccc(CC(=O)NO)cc1
InChIInChI=1S/C12H17NO3/c1-9(2)8-16-11-5-3-10(4-6-11)7-12(14)13-15/h3-6,9,15H,7-8H2,1-2H3,(H,13,14)
InChIKeyOIWYKTQRGOGUJE-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.77
Rot. Bonds5

About N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide

N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide (PubChem CID 53315822) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide
PubChem CID53315822
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC NameN-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide
SMILESCC(C)COc1ccc(CC(=O)NO)cc1
InChIInChI=1S/C12H17NO3/c1-9(2)8-16-11-5-3-10(4-6-11)7-12(14)13-15/h3-6,9,15H,7-8H2,1-2H3,(H,13,14)
InChIKeyOIWYKTQRGOGUJE-UHFFFAOYSA-N
XLogP1.77
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-2-[4-(2-methylpropoxy)phenyl]acetamide?
The IUPAC name of N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide (CID 53315822) is N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide.
What is the SMILES notation for N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide?
The canonical SMILES for N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide is CC(C)COc1ccc(CC(=O)NO)cc1.
What is the InChIKey of N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide?
The InChIKey is OIWYKTQRGOGUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-9(2)8-16-11-5-3-10(4-6-11)7-12(14)13-15/h3-6,9,15H,7-8H2,1-2H3,(H,13,14).
What are the key properties of N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide?
N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide has a molecular weight of 223.27 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[4-(2-methylpropoxy)phenyl]acetamide is sourced from PubChem (CID 53315822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).