2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide

C17H17F2NO3 — CID 51143865

IUPAC2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide
SMILESCCc1cccc(NC(=O)c2cccc(OC)c2OC(F)F)c1
InChIInChI=1S/C17H17F2NO3/c1-3-11-6-4-7-12(10-11)20-16(21)13-8-5-9-14(22-2)15(13)23-17(18)19/h4-10,17H,3H2,1-2H3,(H,20,21)
InChIKeyYURDDNLDVGYPON-UHFFFAOYSA-N
MW321.32 g/mol
LogP4.11
Rot. Bonds6

About 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide

2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide (PubChem CID 51143865) has the molecular formula C17H17F2NO3 and a molecular weight of 321.32 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide.

Molecular Properties

Compound Name2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide
PubChem CID51143865
Molecular FormulaC17H17F2NO3
Molecular Weight321.32 g/mol
Exact Mass321.12
IUPAC Name2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide
SMILESCCc1cccc(NC(=O)c2cccc(OC)c2OC(F)F)c1
InChIInChI=1S/C17H17F2NO3/c1-3-11-6-4-7-12(10-11)20-16(21)13-8-5-9-14(22-2)15(13)23-17(18)19/h4-10,17H,3H2,1-2H3,(H,20,21)
InChIKeyYURDDNLDVGYPON-UHFFFAOYSA-N
XLogP4.11
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.32
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-2-(difluoromethoxy)-3-methoxybenzamide
CID 51148287
2-(difluoromethoxy)-3-methoxy-N-(3-methylsulfanylphenyl)benzamide
CID 51149413
2-(difluoromethoxy)-3-methoxy-N-(4-propylphenyl)benzamide
CID 112765648
N-[4-[[2-(difluoromethoxy)-3-methoxybenzoyl]amino]phenyl]furan-2-carboxamide
CID 55505645
N-benzyl-2-(difluoromethoxy)-3-methoxybenzamide
CID 51147930
N-(5-acetamido-2-fluorophenyl)-2-(difluoromethoxy)-3-methoxybenzamide
CID 55551005
N-(2-benzylphenyl)-2-(difluoromethoxy)-3-methoxybenzamide
CID 55331140
2-(difluoromethoxy)-3-methoxy-N-naphthalen-1-ylbenzamide
CID 112762767
N-[3-chloro-4-(difluoromethoxy)phenyl]-2,3-dimethoxybenzamide
CID 26901544
2-(difluoromethoxy)-3-methoxy-N-quinolin-3-ylbenzamide
CID 51337639
N-[(3-chlorophenyl)methyl]-2-(difluoromethoxy)-3-methoxybenzamide
CID 51158712
2-(difluoromethoxy)-3-methoxy-N-(2-methylpropyl)benzamide
CID 134059564

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide?
The IUPAC name of 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide (CID 51143865) is 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide.
What is the SMILES notation for 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide?
The canonical SMILES for 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide is CCc1cccc(NC(=O)c2cccc(OC)c2OC(F)F)c1.
What is the InChIKey of 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide?
The InChIKey is YURDDNLDVGYPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2NO3/c1-3-11-6-4-7-12(10-11)20-16(21)13-8-5-9-14(22-2)15(13)23-17(18)19/h4-10,17H,3H2,1-2H3,(H,20,21).
What are the key properties of 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide?
2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide has a molecular weight of 321.32 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N-(3-ethylphenyl)-3-methoxybenzamide is sourced from PubChem (CID 51143865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).