3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide

C19H20F2N2O3 — CID 42959688

IUPAC3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide
SMILESCCC(NC(=O)c1cccc(NC(C)=O)c1)c1ccccc1OC(F)F
InChIInChI=1S/C19H20F2N2O3/c1-3-16(15-9-4-5-10-17(15)26-19(20)21)23-18(25)13-7-6-8-14(11-13)22-12(2)24/h4-11,16,19H,3H2,1-2H3,(H,22,24)(H,23,25)
InChIKeySSCDNMJAIFFJOY-UHFFFAOYSA-N
MW362.38 g/mol
LogP4.13
Rot. Bonds7

About 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide

3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide (PubChem CID 42959688) has the molecular formula C19H20F2N2O3 and a molecular weight of 362.38 g/mol. Its IUPAC name is 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide.

Molecular Properties

Compound Name3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide
PubChem CID42959688
Molecular FormulaC19H20F2N2O3
Molecular Weight362.38 g/mol
Exact Mass362.14
IUPAC Name3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide
SMILESCCC(NC(=O)c1cccc(NC(C)=O)c1)c1ccccc1OC(F)F
InChIInChI=1S/C19H20F2N2O3/c1-3-16(15-9-4-5-10-17(15)26-19(20)21)23-18(25)13-7-6-8-14(11-13)22-12(2)24/h4-11,16,19H,3H2,1-2H3,(H,22,24)(H,23,25)
InChIKeySSCDNMJAIFFJOY-UHFFFAOYSA-N
XLogP4.13
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.38
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-benzamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]-4-methylbenzamide
CID 55656426
N-[3-chloro-4-[1-[2-(difluoromethoxy)phenyl]propylcarbamoylamino]phenyl]acetamide
CID 56557227
N-[1-[2-(difluoromethoxy)phenyl]propyl]-3-(pyrrolidin-1-ylmethyl)benzamide
CID 60560678
4-[4-[1-[2-(difluoromethoxy)phenyl]propylcarbamoyl]phenoxy]benzamide
CID 56545716
N-[1-[2-(difluoromethoxy)phenyl]propyl]-1-hydroxy-6-oxopyridine-2-carboxamide
CID 119037362
N-[1-[2-(difluoromethoxy)phenyl]propyl]-4-(ethylsulfamoyl)benzamide
CID 55656191
4-(difluoromethoxy)-N-[2-[1-[2-(difluoromethoxy)phenyl]propylamino]-2-oxoethyl]-3-methoxybenzamide
CID 55656144
N-[3-[(E)-3-[2-(difluoromethoxy)phenyl]prop-2-enoyl]phenyl]acetamide
CID 7947701
N-[1-[2-(difluoromethoxy)phenyl]propyl]-1-oxidopyridin-1-ium-2-carboxamide
CID 60511438
N-[(1S)-1-[2-(difluoromethoxy)phenyl]propyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 38979661
3-acetamido-3-[2-(difluoromethoxy)phenyl]propanoic acid
CID 63651224
1-(2-bromophenyl)-3-[1-[2-(difluoromethoxy)phenyl]propyl]urea
CID 55696855

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide?
The IUPAC name of 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide (CID 42959688) is 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide.
What is the SMILES notation for 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide?
The canonical SMILES for 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide is CCC(NC(=O)c1cccc(NC(C)=O)c1)c1ccccc1OC(F)F.
What is the InChIKey of 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide?
The InChIKey is SSCDNMJAIFFJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N2O3/c1-3-16(15-9-4-5-10-17(15)26-19(20)21)23-18(25)13-7-6-8-14(11-13)22-12(2)24/h4-11,16,19H,3H2,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide?
3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide has a molecular weight of 362.38 g/mol, XLogP of 4.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-[1-[2-(difluoromethoxy)phenyl]propyl]benzamide is sourced from PubChem (CID 42959688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).