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

C16H15F2NO3 — CID 110879156

IUPAC2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(OC(F)F)cc1)Nc1cccc(CO)c1
InChIInChI=1S/C16H15F2NO3/c17-16(18)22-14-6-4-11(5-7-14)9-15(21)19-13-3-1-2-12(8-13)10-20/h1-8,16,20H,9-10H2,(H,19,21)
InChIKeyRRGCCVWWPVTYLT-UHFFFAOYSA-N
MW307.30 g/mol
LogP2.96
Rot. Bonds6

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

2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide (PubChem CID 110879156) has the molecular formula C16H15F2NO3 and a molecular weight of 307.30 g/mol. Its IUPAC name is 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
PubChem CID110879156
Molecular FormulaC16H15F2NO3
Molecular Weight307.30 g/mol
Exact Mass307.10
IUPAC Name2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(OC(F)F)cc1)Nc1cccc(CO)c1
InChIInChI=1S/C16H15F2NO3/c17-16(18)22-14-6-4-11(5-7-14)9-15(21)19-13-3-1-2-12(8-13)10-20/h1-8,16,20H,9-10H2,(H,19,21)
InChIKeyRRGCCVWWPVTYLT-UHFFFAOYSA-N
XLogP2.96
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.30
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(difluoromethoxy)phenyl]-2-[3-(hydroxymethyl)anilino]propanamide
CID 110878851
N-(4-acetamidophenyl)-2-[4-(difluoromethoxy)phenyl]acetamide
CID 35049094
2-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)acetamide
CID 33142215
[3-(difluoromethoxy)phenyl]methanol
CID 2736994
2-[4-(difluoromethoxy)phenyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 35621741
N-[4-(difluoromethoxy)phenyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 27147330
1-[3-(difluoromethoxy)phenyl]-3-[[4-(difluoromethoxy)phenyl]methyl]urea
CID 55738771
N-[4-(difluoromethoxy)phenyl]-2-(4-nitrophenyl)acetamide
CID 9405238
N-[3-(difluoromethoxy)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 55742320
[3-[[4-(difluoromethoxy)phenyl]methoxy]phenyl]methanol
CID 111770249
N-[3-(hydroxymethyl)phenyl]propanamide
CID 12959862
2-[4-(difluoromethoxy)phenyl]-N-[(3-methylphenyl)methyl]acetamide
CID 33280716

Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
The IUPAC name of 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide (CID 110879156) is 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide.
What is the SMILES notation for 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
The canonical SMILES for 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide is O=C(Cc1ccc(OC(F)F)cc1)Nc1cccc(CO)c1.
What is the InChIKey of 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
The InChIKey is RRGCCVWWPVTYLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO3/c17-16(18)22-14-6-4-11(5-7-14)9-15(21)19-13-3-1-2-12(8-13)10-20/h1-8,16,20H,9-10H2,(H,19,21).
What are the key properties of 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide?
2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide has a molecular weight of 307.30 g/mol, XLogP of 2.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethoxy)phenyl]-N-[3-(hydroxymethyl)phenyl]acetamide is sourced from PubChem (CID 110879156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).