N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide

C11H13NO3 — CID 21422515

IUPACN-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide
SMILESCOc1cc(/C=C/NC(C)=O)ccc1O
InChIInChI=1S/C11H13NO3/c1-8(13)12-6-5-9-3-4-10(14)11(7-9)15-2/h3-7,14H,1-2H3,(H,12,13)/b6-5+
InChIKeyBIEXZDUFIHCWSH-AATRIKPKSA-N
MW207.23 g/mol
LogP1.51
Rot. Bonds3

About N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide

N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide (PubChem CID 21422515) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide.

Molecular Properties

Compound NameN-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide
PubChem CID21422515
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC NameN-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide
SMILESCOc1cc(/C=C/NC(C)=O)ccc1O
InChIInChI=1S/C11H13NO3/c1-8(13)12-6-5-9-3-4-10(14)11(7-9)15-2/h3-7,14H,1-2H3,(H,12,13)/b6-5+
InChIKeyBIEXZDUFIHCWSH-AATRIKPKSA-N
XLogP1.51
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CID 969516
CID 174827534
CID 174827534
(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione;silver
CID 174575212
N-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enyl]acetamide
CID 169465296
benzene;(1E,6E)-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,6-diene-3,5-dione
CID 174945129
[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-eneperoxoate
CID 155779332
azane;(Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
CID 25050146
methyl (2E,4E)-5-(4-hydroxy-3-methoxyphenyl)penta-2,4-dienoate
CID 152502233
N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]acetamide
CID 135491260
methyl (2Z,4E)-5-(4-hydroxy-3-methoxyphenyl)penta-2,4-dienoate
CID 166068269
3-(4-hydroxy-3-methoxyphenyl)prop-2-enal;(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enal
CID 172694499
trisodium;hydride;3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid
CID 174973622

Frequently Asked Questions

What is the IUPAC name of N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide?
The IUPAC name of N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide (CID 21422515) is N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide.
What is the SMILES notation for N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide?
The canonical SMILES for N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide is COc1cc(/C=C/NC(C)=O)ccc1O.
What is the InChIKey of N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide?
The InChIKey is BIEXZDUFIHCWSH-AATRIKPKSA-N. The full InChI is InChI=1S/C11H13NO3/c1-8(13)12-6-5-9-3-4-10(14)11(7-9)15-2/h3-7,14H,1-2H3,(H,12,13)/b6-5+.
What are the key properties of N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide?
N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide has a molecular weight of 207.23 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]acetamide is sourced from PubChem (CID 21422515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).