3-fluoro-4-(2-hydroxyethyl)benzamide

C9H10FNO2 — CID 175907153

IUPAC3-fluoro-4-(2-hydroxyethyl)benzamide
SMILESNC(=O)c1ccc(CCO)c(F)c1
InChIInChI=1S/C9H10FNO2/c10-8-5-7(9(11)13)2-1-6(8)3-4-12/h1-2,5,12H,3-4H2,(H2,11,13)
InChIKeyGCBMDIHRJOMRPH-UHFFFAOYSA-N
MW183.18 g/mol
LogP0.46
Rot. Bonds3

About 3-fluoro-4-(2-hydroxyethyl)benzamide

3-fluoro-4-(2-hydroxyethyl)benzamide (PubChem CID 175907153) has the molecular formula C9H10FNO2 and a molecular weight of 183.18 g/mol. Its IUPAC name is 3-fluoro-4-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name3-fluoro-4-(2-hydroxyethyl)benzamide
PubChem CID175907153
Molecular FormulaC9H10FNO2
Molecular Weight183.18 g/mol
Exact Mass183.07
IUPAC Name3-fluoro-4-(2-hydroxyethyl)benzamide
SMILESNC(=O)c1ccc(CCO)c(F)c1
InChIInChI=1S/C9H10FNO2/c10-8-5-7(9(11)13)2-1-6(8)3-4-12/h1-2,5,12H,3-4H2,(H2,11,13)
InChIKeyGCBMDIHRJOMRPH-UHFFFAOYSA-N
XLogP0.46
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.18
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-4-[[(1-hydroxy-2-methylbutan-2-yl)amino]methyl]benzamide
CID 64549762
4-[[ethyl(2-hydroxyethyl)amino]methyl]-3-fluorobenzamide
CID 62021395
3-fluoro-4-[4-(2-hydroxyethyl)phenoxy]benzamide
CID 107709668
4-fluoro-3-(hydroxymethyl)benzamide
CID 43558815
4-[[4-(2-aminoethyl)phenoxy]methyl]-3-fluorobenzamide
CID 65362266
4-(2-aminoethyl)-3-fluorobenzoic acid
CID 68728467
4-[(tert-butylamino)methyl]-3-fluorobenzamide
CID 28586612
3-fluoro-4-[[2-(3-hydroxypropylsulfanyl)ethylamino]methyl]benzamide
CID 106310179
3-fluoro-4-[(4-oxo-1-pyridinyl)methyl]benzamide
CID 116622136
2-[(4-carbamoyl-2-fluorophenyl)methylsulfinyl]acetic acid
CID 60982846
4-[[3-(dimethylamino)propylamino]methyl]-3-fluorobenzamide
CID 28583705
4-[(3-bromo-4-fluorophenoxy)methyl]-3-fluorobenzamide
CID 83231247

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-(2-hydroxyethyl)benzamide?
The IUPAC name of 3-fluoro-4-(2-hydroxyethyl)benzamide (CID 175907153) is 3-fluoro-4-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 3-fluoro-4-(2-hydroxyethyl)benzamide?
The canonical SMILES for 3-fluoro-4-(2-hydroxyethyl)benzamide is NC(=O)c1ccc(CCO)c(F)c1.
What is the InChIKey of 3-fluoro-4-(2-hydroxyethyl)benzamide?
The InChIKey is GCBMDIHRJOMRPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c10-8-5-7(9(11)13)2-1-6(8)3-4-12/h1-2,5,12H,3-4H2,(H2,11,13).
What are the key properties of 3-fluoro-4-(2-hydroxyethyl)benzamide?
3-fluoro-4-(2-hydroxyethyl)benzamide has a molecular weight of 183.18 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 175907153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).