N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide

C10H11NO3 — CID 123173944

IUPACN-hydroxy-3-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1ccccc1C=CC(=O)NO
InChIInChI=1S/C10H11NO3/c1-14-9-5-3-2-4-8(9)6-7-10(12)11-13/h2-7,13H,1H3,(H,11,12)
InChIKeyQCCFLBSMCXEOJJ-UHFFFAOYSA-N
MW193.20 g/mol
LogP1.21
Rot. Bonds3

About N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide

N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide (PubChem CID 123173944) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide.

Molecular Properties

Compound NameN-hydroxy-3-(2-methoxyphenyl)prop-2-enamide
PubChem CID123173944
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC NameN-hydroxy-3-(2-methoxyphenyl)prop-2-enamide
SMILESCOc1ccccc1C=CC(=O)NO
InChIInChI=1S/C10H11NO3/c1-14-9-5-3-2-4-8(9)6-7-10(12)11-13/h2-7,13H,1H3,(H,11,12)
InChIKeyQCCFLBSMCXEOJJ-UHFFFAOYSA-N
XLogP1.21
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', '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-3-(2-methoxyphenyl)prop-2-enamide?
The IUPAC name of N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide (CID 123173944) is N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide.
What is the SMILES notation for N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide?
The canonical SMILES for N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide is COc1ccccc1C=CC(=O)NO.
What is the InChIKey of N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide?
The InChIKey is QCCFLBSMCXEOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO3/c1-14-9-5-3-2-4-8(9)6-7-10(12)11-13/h2-7,13H,1H3,(H,11,12).
What are the key properties of N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide?
N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide has a molecular weight of 193.20 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-3-(2-methoxyphenyl)prop-2-enamide is sourced from PubChem (CID 123173944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).