4-fluoro-3-(hydroxymethyl)benzamide

C8H8FNO2 — CID 43558815

IUPAC4-fluoro-3-(hydroxymethyl)benzamide
SMILESNC(=O)c1ccc(F)c(CO)c1
InChIInChI=1S/C8H8FNO2/c9-7-2-1-5(8(10)12)3-6(7)4-11/h1-3,11H,4H2,(H2,10,12)
InChIKeyWFEJFQFKIOZNBP-UHFFFAOYSA-N
MW169.16 g/mol
LogP0.42
Rot. Bonds2

About 4-fluoro-3-(hydroxymethyl)benzamide

4-fluoro-3-(hydroxymethyl)benzamide (PubChem CID 43558815) has the molecular formula C8H8FNO2 and a molecular weight of 169.16 g/mol. Its IUPAC name is 4-fluoro-3-(hydroxymethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-3-(hydroxymethyl)benzamide
PubChem CID43558815
Molecular FormulaC8H8FNO2
Molecular Weight169.16 g/mol
Exact Mass169.05
IUPAC Name4-fluoro-3-(hydroxymethyl)benzamide
SMILESNC(=O)c1ccc(F)c(CO)c1
InChIInChI=1S/C8H8FNO2/c9-7-2-1-5(8(10)12)3-6(7)4-11/h1-3,11H,4H2,(H2,10,12)
InChIKeyWFEJFQFKIOZNBP-UHFFFAOYSA-N
XLogP0.42
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.16
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[bis(2-hydroxyethyl)amino]methyl]-4-fluorobenzamide
CID 62020933
4-fluoro-3-[(4-hydroxyphenoxy)methyl]benzamide
CID 43326289
3-[(4-chlorophenoxy)methyl]-4-fluorobenzamide
CID 64763801
4-fluoro-3-[(3-hydroxypropylamino)methyl]benzamide
CID 43499997
4-fluoro-3-[(2-hydroxyphenoxy)methyl]benzamide
CID 43143477
3-[(3,5-dimethylphenoxy)methyl]-4-fluorobenzamide
CID 65202032
4-fluoro-3-[(propan-2-ylamino)methyl]benzamide
CID 24694362
4-fluoro-3-[[(1-hydroxy-3-methylbutan-2-yl)amino]methyl]benzamide
CID 79249549
3-fluoro-4-(2-hydroxyethyl)benzamide
CID 175907153
1-[4-fluoro-3-(hydroxymethyl)phenyl]-2-(methylamino)ethanone
CID 117286820
4-fluoro-3-[(pyrrol-1-ylamino)methyl]benzamide
CID 79100839
3-[(2-bromo-4-fluorophenoxy)methyl]-4-fluorobenzamide
CID 24704635

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-3-(hydroxymethyl)benzamide?
The IUPAC name of 4-fluoro-3-(hydroxymethyl)benzamide (CID 43558815) is 4-fluoro-3-(hydroxymethyl)benzamide.
What is the SMILES notation for 4-fluoro-3-(hydroxymethyl)benzamide?
The canonical SMILES for 4-fluoro-3-(hydroxymethyl)benzamide is NC(=O)c1ccc(F)c(CO)c1.
What is the InChIKey of 4-fluoro-3-(hydroxymethyl)benzamide?
The InChIKey is WFEJFQFKIOZNBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO2/c9-7-2-1-5(8(10)12)3-6(7)4-11/h1-3,11H,4H2,(H2,10,12).
What are the key properties of 4-fluoro-3-(hydroxymethyl)benzamide?
4-fluoro-3-(hydroxymethyl)benzamide has a molecular weight of 169.16 g/mol, XLogP of 0.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-3-(hydroxymethyl)benzamide is sourced from PubChem (CID 43558815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).