N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide

C12H15NO2 — CID 102363599

IUPACN-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide
SMILESCOc1ccccc1/C=C(\C)NC(C)=O
InChIInChI=1S/C12H15NO2/c1-9(13-10(2)14)8-11-6-4-5-7-12(11)15-3/h4-8H,1-3H3,(H,13,14)/b9-8+
InChIKeyHNEFEXUVHVMYNQ-CMDGGOBGSA-N
MW205.26 g/mol
LogP2.19
Rot. Bonds3

About N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide

N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide (PubChem CID 102363599) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide.

Molecular Properties

Compound NameN-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide
PubChem CID102363599
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC NameN-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide
SMILESCOc1ccccc1/C=C(\C)NC(C)=O
InChIInChI=1S/C12H15NO2/c1-9(13-10(2)14)8-11-6-4-5-7-12(11)15-3/h4-8H,1-3H3,(H,13,14)/b9-8+
InChIKeyHNEFEXUVHVMYNQ-CMDGGOBGSA-N
XLogP2.19
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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(2E,3E)-2,3-bis[(2-methoxyphenyl)methylidene]butanedial
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CID 3610354
N-[3-(2-methoxyphenyl)prop-2-enyl]acetamide
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3-(2-methoxyphenyl)-2-methylprop-2-en-1-amine
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1-[(Z)-3-chloro-2-methylprop-1-enyl]-2-methoxybenzene
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methyl 2-[(E)-1-fluoro-2-(2-methoxyphenyl)ethenyl]benzoate
CID 146798772
N-[(E)-3-(2-benzoylhydrazinyl)-1-(2-methoxyphenyl)-3-oxoprop-1-en-2-yl]benzamide
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CID 170488272

Frequently Asked Questions

What is the IUPAC name of N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide?
The IUPAC name of N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide (CID 102363599) is N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide.
What is the SMILES notation for N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide?
The canonical SMILES for N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide is COc1ccccc1/C=C(\C)NC(C)=O.
What is the InChIKey of N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide?
The InChIKey is HNEFEXUVHVMYNQ-CMDGGOBGSA-N. The full InChI is InChI=1S/C12H15NO2/c1-9(13-10(2)14)8-11-6-4-5-7-12(11)15-3/h4-8H,1-3H3,(H,13,14)/b9-8+.
What are the key properties of N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide?
N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide has a molecular weight of 205.26 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-1-(2-methoxyphenyl)prop-1-en-2-yl]acetamide is sourced from PubChem (CID 102363599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).