N-[2-[(E)-prop-1-enoxy]phenyl]acetamide

C11H13NO2 — CID 22313764

IUPACN-[2-[(E)-prop-1-enoxy]phenyl]acetamide
SMILESC/C=C/Oc1ccccc1NC(C)=O
InChIInChI=1S/C11H13NO2/c1-3-8-14-11-7-5-4-6-10(11)12-9(2)13/h3-8H,1-2H3,(H,12,13)/b8-3+
InChIKeyTUVFSLPLNVNSJA-FPYGCLRLSA-N
MW191.23 g/mol
LogP2.56
Rot. Bonds3

About N-[2-[(E)-prop-1-enoxy]phenyl]acetamide

N-[2-[(E)-prop-1-enoxy]phenyl]acetamide (PubChem CID 22313764) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is N-[2-[(E)-prop-1-enoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(E)-prop-1-enoxy]phenyl]acetamide
PubChem CID22313764
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC NameN-[2-[(E)-prop-1-enoxy]phenyl]acetamide
SMILESC/C=C/Oc1ccccc1NC(C)=O
InChIInChI=1S/C11H13NO2/c1-3-8-14-11-7-5-4-6-10(11)12-9(2)13/h3-8H,1-2H3,(H,12,13)/b8-3+
InChIKeyTUVFSLPLNVNSJA-FPYGCLRLSA-N
XLogP2.56
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

N-(2-ethenoxyphenyl)acetamide
CID 66367179
(2-acetamidophenyl) hypochlorite
CID 150463309
N-[2-[4-(2-acetamidophenoxy)butoxy]phenyl]acetamide
CID 3708150
N-[2-[10-(2-acetamidophenoxy)decoxy]phenyl]acetamide
CID 4569719
methyl 2-(2-acetamidophenoxy)propanoate
CID 54941686
N-[2-(2,6-difluorophenoxy)phenyl]acetamide
CID 142846289
N-[2-[2-methyl-1-[(2-methylpropan-2-yl)oxy]but-2-enoxy]phenyl]acetamide
CID 70554989
N-[2-(2-prop-2-enoxyethoxy)phenyl]acetamide
CID 86096394
(E)-4-(2-acetamidophenoxy)but-2-enoic acid
CID 55065855
N-[2-[2-(2-methylphenoxy)ethoxy]phenyl]acetamide
CID 9017902
N-[2-(4-oxopentan-2-yloxy)phenyl]acetamide
CID 64698163
N-[2-[(E)-3-phenylprop-2-enoxy]phenyl]acetamide
CID 13123868

Frequently Asked Questions

What is the IUPAC name of N-[2-[(E)-prop-1-enoxy]phenyl]acetamide?
The IUPAC name of N-[2-[(E)-prop-1-enoxy]phenyl]acetamide (CID 22313764) is N-[2-[(E)-prop-1-enoxy]phenyl]acetamide.
What is the SMILES notation for N-[2-[(E)-prop-1-enoxy]phenyl]acetamide?
The canonical SMILES for N-[2-[(E)-prop-1-enoxy]phenyl]acetamide is C/C=C/Oc1ccccc1NC(C)=O.
What is the InChIKey of N-[2-[(E)-prop-1-enoxy]phenyl]acetamide?
The InChIKey is TUVFSLPLNVNSJA-FPYGCLRLSA-N. The full InChI is InChI=1S/C11H13NO2/c1-3-8-14-11-7-5-4-6-10(11)12-9(2)13/h3-8H,1-2H3,(H,12,13)/b8-3+.
What are the key properties of N-[2-[(E)-prop-1-enoxy]phenyl]acetamide?
N-[2-[(E)-prop-1-enoxy]phenyl]acetamide has a molecular weight of 191.23 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(E)-prop-1-enoxy]phenyl]acetamide is sourced from PubChem (CID 22313764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).