N-[[4-(difluoromethoxy)phenyl]methyl]acetamide

C10H11F2NO2 — CID 51072984

IUPACN-[[4-(difluoromethoxy)phenyl]methyl]acetamide
SMILESCC(=O)NCc1ccc(OC(F)F)cc1
InChIInChI=1S/C10H11F2NO2/c1-7(14)13-6-8-2-4-9(5-3-8)15-10(11)12/h2-5,10H,6H2,1H3,(H,13,14)
InChIKeyQFULNIDEXJIJCJ-UHFFFAOYSA-N
MW215.20 g/mol
LogP1.92
Rot. Bonds4

About N-[[4-(difluoromethoxy)phenyl]methyl]acetamide

N-[[4-(difluoromethoxy)phenyl]methyl]acetamide (PubChem CID 51072984) has the molecular formula C10H11F2NO2 and a molecular weight of 215.20 g/mol. Its IUPAC name is N-[[4-(difluoromethoxy)phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[4-(difluoromethoxy)phenyl]methyl]acetamide
PubChem CID51072984
Molecular FormulaC10H11F2NO2
Molecular Weight215.20 g/mol
Exact Mass215.08
IUPAC NameN-[[4-(difluoromethoxy)phenyl]methyl]acetamide
SMILESCC(=O)NCc1ccc(OC(F)F)cc1
InChIInChI=1S/C10H11F2NO2/c1-7(14)13-6-8-2-4-9(5-3-8)15-10(11)12/h2-5,10H,6H2,1H3,(H,13,14)
InChIKeyQFULNIDEXJIJCJ-UHFFFAOYSA-N
XLogP1.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.20
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]acetamide;hydrochloride
CID 119271340
(2R)-2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]-3-methylbutanamide
CID 79012907
N-[[4-(difluoromethoxy)phenyl]methyl]-4-hydroxypentanamide
CID 79200943
4-[[4-(difluoromethoxy)phenyl]methylamino]-4-oxobutanoic acid
CID 54867549
N-[[4-(difluoromethoxy)phenyl]methyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119689663
2-(azetidin-3-ylidene)-N-[[4-(difluoromethoxy)phenyl]methyl]propanamide
CID 116677152
N-[[4-(difluoromethoxy)phenyl]methyl]-2-methylprop-2-en-1-amine
CID 115574779
N-[(4-methoxyphenyl)methyl]acetamide;hydrochloride
CID 139808929
[4-(acetamidomethyl)phenyl] acetate
CID 15576450
2-(aminomethyl)-N-[[4-(difluoromethoxy)phenyl]methyl]butanamide
CID 65229370
4-[[4-(difluoromethoxy)phenyl]methylamino]-2,2-dimethyl-4-oxobutanoic acid
CID 65302546
N-[[4-(difluoromethoxy)phenyl]methyl]-2-(4-methylphenoxy)acetamide
CID 42005185

Frequently Asked Questions

What is the IUPAC name of N-[[4-(difluoromethoxy)phenyl]methyl]acetamide?
The IUPAC name of N-[[4-(difluoromethoxy)phenyl]methyl]acetamide (CID 51072984) is N-[[4-(difluoromethoxy)phenyl]methyl]acetamide.
What is the SMILES notation for N-[[4-(difluoromethoxy)phenyl]methyl]acetamide?
The canonical SMILES for N-[[4-(difluoromethoxy)phenyl]methyl]acetamide is CC(=O)NCc1ccc(OC(F)F)cc1.
What is the InChIKey of N-[[4-(difluoromethoxy)phenyl]methyl]acetamide?
The InChIKey is QFULNIDEXJIJCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO2/c1-7(14)13-6-8-2-4-9(5-3-8)15-10(11)12/h2-5,10H,6H2,1H3,(H,13,14).
What are the key properties of N-[[4-(difluoromethoxy)phenyl]methyl]acetamide?
N-[[4-(difluoromethoxy)phenyl]methyl]acetamide has a molecular weight of 215.20 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(difluoromethoxy)phenyl]methyl]acetamide is sourced from PubChem (CID 51072984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).