4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide

C10H10FNO2 — CID 169453706

IUPAC4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide
SMILESNC(=O)c1ccc(F)cc1C=CCO
InChIInChI=1S/C10H10FNO2/c11-8-3-4-9(10(12)14)7(6-8)2-1-5-13/h1-4,6,13H,5H2,(H2,12,14)
InChIKeyOAQCSVPJAZQLBO-UHFFFAOYSA-N
MW195.19 g/mol
LogP0.93
Rot. Bonds3

About 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide

4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide (PubChem CID 169453706) has the molecular formula C10H10FNO2 and a molecular weight of 195.19 g/mol. Its IUPAC name is 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide
PubChem CID169453706
Molecular FormulaC10H10FNO2
Molecular Weight195.19 g/mol
Exact Mass195.07
IUPAC Name4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide
SMILESNC(=O)c1ccc(F)cc1C=CCO
InChIInChI=1S/C10H10FNO2/c11-8-3-4-9(10(12)14)7(6-8)2-1-5-13/h1-4,6,13H,5H2,(H2,12,14)
InChIKeyOAQCSVPJAZQLBO-UHFFFAOYSA-N
XLogP0.93
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.19
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-carbamoyl-5-fluorophenyl)prop-2-enoic acid
CID 169460732
2-(4-acetamidobut-1-enyl)-4-fluorobenzamide
CID 170489130
5-fluoro-2-(3-hydroxyprop-1-enyl)benzaldehyde
CID 169453203
2-ethenyl-4-fluorobenzamide
CID 122232501
1-[4-fluoro-2-(4-hydroxybut-1-enyl)phenyl]ethanone
CID 170476850
(E)-3-(5-fluoro-2-prop-2-enylphenyl)prop-2-en-1-ol
CID 121012780
2,4-difluorobenzamide;dihydrochloride
CID 22032026
2-(aminomethyl)-4-fluorobenzamide
CID 174538436
2-(3-amino-3-oxoprop-1-enyl)-4-fluorobenzoic acid
CID 169481992
5-fluoro-2-(3-hydroxypropanoyl)benzamide
CID 18700444
2-(4-chlorobut-1-enyl)-4-fluorobenzoic acid
CID 170499388
9H-fluoren-9-ylmethyl N-[4-(2-carbamoyl-5-fluorophenyl)but-3-enyl]carbamate
CID 170492707

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide?
The IUPAC name of 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide (CID 169453706) is 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide.
What is the SMILES notation for 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide?
The canonical SMILES for 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide is NC(=O)c1ccc(F)cc1C=CCO.
What is the InChIKey of 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide?
The InChIKey is OAQCSVPJAZQLBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FNO2/c11-8-3-4-9(10(12)14)7(6-8)2-1-5-13/h1-4,6,13H,5H2,(H2,12,14).
What are the key properties of 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide?
4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide has a molecular weight of 195.19 g/mol, XLogP of 0.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(3-hydroxyprop-1-enyl)benzamide is sourced from PubChem (CID 169453706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).