N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide

C11H12FNO2 — CID 169465029

IUPACN-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1cccc(F)c1O
InChIInChI=1S/C11H12FNO2/c1-8(14)13-7-3-5-9-4-2-6-10(12)11(9)15/h2-6,15H,7H2,1H3,(H,13,14)
InChIKeyPJPVDTLGKWQCON-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.68
Rot. Bonds3

About N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide

N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide (PubChem CID 169465029) has the molecular formula C11H12FNO2 and a molecular weight of 209.22 g/mol. Its IUPAC name is N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide
PubChem CID169465029
Molecular FormulaC11H12FNO2
Molecular Weight209.22 g/mol
Exact Mass209.09
IUPAC NameN-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1cccc(F)c1O
InChIInChI=1S/C11H12FNO2/c1-8(14)13-7-3-5-9-4-2-6-10(12)11(9)15/h2-6,15H,7H2,1H3,(H,13,14)
InChIKeyPJPVDTLGKWQCON-UHFFFAOYSA-N
XLogP1.68
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(5-chloro-2-fluorophenyl)prop-2-enyl]acetamide
CID 169464994
N-[3-(2,3-dichlorophenyl)prop-2-enyl]acetamide
CID 169464992
N-(3-naphthalen-1-ylprop-2-enyl)acetamide
CID 169465612
N-[3-(5-acetyl-2-fluorophenyl)prop-2-enyl]acetamide
CID 169465750
N-[3-(2-amino-3-methylphenyl)prop-2-enyl]acetamide
CID 169465158
N-[3-(2-bromo-4-chlorophenyl)prop-2-enyl]acetamide
CID 169466504
3-(3-acetamidoprop-1-enyl)-2-methylbenzoic acid
CID 169465735
N-[3-[2-chloro-3-(trifluoromethyl)phenyl]prop-2-enyl]acetamide
CID 169466678
N-[3-(2-methoxyphenyl)prop-2-enyl]acetamide
CID 169465048
2-fluoro-6-(4-hydroxybut-1-enyl)phenol
CID 170476150
4-(3-acetamidoprop-1-enyl)-2,5-difluorobenzoic acid
CID 169466002
N-[3-[2-fluoro-4-(trifluoromethyl)phenyl]prop-2-enyl]acetamide
CID 169465950

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide?
The IUPAC name of N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide (CID 169465029) is N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide.
What is the SMILES notation for N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide?
The canonical SMILES for N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide is CC(=O)NCC=Cc1cccc(F)c1O.
What is the InChIKey of N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide?
The InChIKey is PJPVDTLGKWQCON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FNO2/c1-8(14)13-7-3-5-9-4-2-6-10(12)11(9)15/h2-6,15H,7H2,1H3,(H,13,14).
What are the key properties of N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide?
N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide has a molecular weight of 209.22 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-fluoro-2-hydroxyphenyl)prop-2-enyl]acetamide is sourced from PubChem (CID 169465029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).