3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide

C10H13FN2O2 — CID 115180231

IUPAC3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide
SMILESCc1cc(NC(=O)C(O)CN)ccc1F
InChIInChI=1S/C10H13FN2O2/c1-6-4-7(2-3-8(6)11)13-10(15)9(14)5-12/h2-4,9,14H,5,12H2,1H3,(H,13,15)
InChIKeyJKMGXUHKFKNWLU-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.39
Rot. Bonds3

About 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide

3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide (PubChem CID 115180231) has the molecular formula C10H13FN2O2 and a molecular weight of 212.22 g/mol. Its IUPAC name is 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide.

Molecular Properties

Compound Name3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide
PubChem CID115180231
Molecular FormulaC10H13FN2O2
Molecular Weight212.22 g/mol
Exact Mass212.10
IUPAC Name3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide
SMILESCc1cc(NC(=O)C(O)CN)ccc1F
InChIInChI=1S/C10H13FN2O2/c1-6-4-7(2-3-8(6)11)13-10(15)9(14)5-12/h2-4,9,14H,5,12H2,1H3,(H,13,15)
InChIKeyJKMGXUHKFKNWLU-UHFFFAOYSA-N
XLogP0.39
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide
CID 115140347
(2S)-2-amino-N-(4-fluoro-3-methylphenyl)propanamide
CID 62813030
2-bromo-N-(4-fluoro-3-methylphenyl)butanamide
CID 62856020
3-amino-N-(4-fluoro-3-methylphenyl)propanamide;hydrochloride
CID 75530834
2-amino-N-(4-fluoro-3-methylphenyl)-2-phenylacetamide
CID 55118745
(2S)-2-amino-N-(4-fluoro-3-methylphenyl)-4-methylsulfanylbutanamide
CID 55119461
6-amino-N-(4-fluoro-3-methylphenyl)-2-methylheptanamide
CID 65291128
(2R)-2-amino-N-(4-fluoro-3-methylphenyl)-3-phenylpropanamide
CID 78917568
4-amino-N-(4-fluoro-3-methylphenyl)butanamide;hydrochloride
CID 119280533
N-(4-fluoro-3-methylphenyl)-3-methylbutanamide
CID 110776354
N-(4-fluoro-3-methylphenyl)-2-hydrazinyl-2-oxoacetamide
CID 62813947
2-cyano-N-(4-fluoro-3-methylphenyl)-3-oxobutanamide
CID 54542858

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide?
The IUPAC name of 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide (CID 115180231) is 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide.
What is the SMILES notation for 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide?
The canonical SMILES for 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide is Cc1cc(NC(=O)C(O)CN)ccc1F.
What is the InChIKey of 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide?
The InChIKey is JKMGXUHKFKNWLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2/c1-6-4-7(2-3-8(6)11)13-10(15)9(14)5-12/h2-4,9,14H,5,12H2,1H3,(H,13,15).
What are the key properties of 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide?
3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide has a molecular weight of 212.22 g/mol, XLogP of 0.39, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-fluoro-3-methylphenyl)-2-hydroxypropanamide is sourced from PubChem (CID 115180231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).