N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide

C9H9F2NO2 — CID 67281170

IUPACN-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)c(CO)c1F
InChIInChI=1S/C9H9F2NO2/c1-5(14)12-8-3-2-7(10)6(4-13)9(8)11/h2-3,13H,4H2,1H3,(H,12,14)
InChIKeyHLRZPNKJCRVAHE-UHFFFAOYSA-N
MW201.17 g/mol
LogP1.42
Rot. Bonds2

About N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide

N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide (PubChem CID 67281170) has the molecular formula C9H9F2NO2 and a molecular weight of 201.17 g/mol. Its IUPAC name is N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide
PubChem CID67281170
Molecular FormulaC9H9F2NO2
Molecular Weight201.17 g/mol
Exact Mass201.06
IUPAC NameN-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)c(CO)c1F
InChIInChI=1S/C9H9F2NO2/c1-5(14)12-8-3-2-7(10)6(4-13)9(8)11/h2-3,13H,4H2,1H3,(H,12,14)
InChIKeyHLRZPNKJCRVAHE-UHFFFAOYSA-N
XLogP1.42
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.17
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-difluoro-2-methylphenyl)acetamide
CID 15692403
N-(3,4-difluoro-2-trimethylsilylphenyl)acetamide
CID 101479656
N-(4-chloro-2-fluorophenyl)acetamide;hydrochloride
CID 142696618
2-methoxy-N-(2,3,4-trifluorophenyl)propanamide
CID 112685527
N-(2-fluoro-4-iodo-3-methylphenyl)acetamide
CID 166153622
N-[2-(hydroxymethyl)-3-methylphenyl]acetamide
CID 14368464
(3-acetamido-6-chloro-2-fluorophenyl)methyl methanesulfonate
CID 86713626
methyl 2-[(6-acetamido-2,3-difluorophenyl)methyl]-3-oxobutanoate
CID 139639954
N-(4-acetamido-2,5-difluorophenyl)acetamide
CID 176892585
N-[3-bromo-2-(hydroxymethyl)phenyl]acetamide
CID 130718807
ethane;N-(2-fluoro-3-methylphenyl)acetamide
CID 145070564
N-[2-fluoro-3,4-di(propan-2-yl)phenyl]acetamide
CID 168959540

Frequently Asked Questions

What is the IUPAC name of N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide?
The IUPAC name of N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide (CID 67281170) is N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide.
What is the SMILES notation for N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide?
The canonical SMILES for N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide is CC(=O)Nc1ccc(F)c(CO)c1F.
What is the InChIKey of N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide?
The InChIKey is HLRZPNKJCRVAHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F2NO2/c1-5(14)12-8-3-2-7(10)6(4-13)9(8)11/h2-3,13H,4H2,1H3,(H,12,14).
What are the key properties of N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide?
N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide has a molecular weight of 201.17 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-difluoro-3-(hydroxymethyl)phenyl]acetamide is sourced from PubChem (CID 67281170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).