N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide

C9H9ClFNO2 — CID 115139648

IUPACN-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide
SMILESCc1cc(Cl)c(NC(=O)CO)cc1F
InChIInChI=1S/C9H9ClFNO2/c1-5-2-6(10)8(3-7(5)11)12-9(14)4-13/h2-3,13H,4H2,1H3,(H,12,14)
InChIKeyFEWRBMUEWZRNEQ-UHFFFAOYSA-N
MW217.63 g/mol
LogP1.72
Rot. Bonds2

About N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide

N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide (PubChem CID 115139648) has the molecular formula C9H9ClFNO2 and a molecular weight of 217.63 g/mol. Its IUPAC name is N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide.

Molecular Properties

Compound NameN-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide
PubChem CID115139648
Molecular FormulaC9H9ClFNO2
Molecular Weight217.63 g/mol
Exact Mass217.03
IUPAC NameN-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide
SMILESCc1cc(Cl)c(NC(=O)CO)cc1F
InChIInChI=1S/C9H9ClFNO2/c1-5-2-6(10)8(3-7(5)11)12-9(14)4-13/h2-3,13H,4H2,1H3,(H,12,14)
InChIKeyFEWRBMUEWZRNEQ-UHFFFAOYSA-N
XLogP1.72
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.63
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-(2-chloro-5-fluoro-4-methylphenyl)acetamide
CID 115161861
N-(2-chloro-5-fluoro-4-methylphenyl)-2-oxopropanamide
CID 115175416
3-chloro-N-(2-chloro-4-fluoro-5-methylphenyl)propanamide
CID 130520854
N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxy-2-methylpropanamide
CID 115178606
N-(2-chloro-4-fluoro-5-methylphenyl)-2-(propan-2-ylamino)acetamide
CID 112734747
6-amino-N-(2-chloro-4-fluoro-5-methylphenyl)hexanamide
CID 112734750
N-(5-chloro-2-fluorophenyl)-2-hydroxyacetamide
CID 16769009
3-(2-chloro-5-fluoro-4-methylanilino)propan-1-ol
CID 115216703
ethyl 2-(2-chloro-5-fluoro-4-methylanilino)acetate
CID 115257255
N'-(2-chloro-5-fluoro-4-methylphenyl)methanediamine
CID 115225495
N-(2-chloro-5-fluoro-4-methylphenyl)-3-cyanooxetane-3-carboxamide
CID 115184615
(3Z)-3-amino-N-(2,5-dichloro-4-methylphenyl)-3-hydroxyiminopropanamide
CID 104727903

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide?
The IUPAC name of N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide (CID 115139648) is N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide.
What is the SMILES notation for N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide?
The canonical SMILES for N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide is Cc1cc(Cl)c(NC(=O)CO)cc1F.
What is the InChIKey of N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide?
The InChIKey is FEWRBMUEWZRNEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClFNO2/c1-5-2-6(10)8(3-7(5)11)12-9(14)4-13/h2-3,13H,4H2,1H3,(H,12,14).
What are the key properties of N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide?
N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide has a molecular weight of 217.63 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-5-fluoro-4-methylphenyl)-2-hydroxyacetamide is sourced from PubChem (CID 115139648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).