N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide

C18H18F2N2O4 — CID 33178137

IUPACN-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)Cc1ccc(OC(F)F)cc1
InChIInChI=1S/C18H18F2N2O4/c1-11(23)21-13-5-8-16(25-2)15(10-13)22-17(24)9-12-3-6-14(7-4-12)26-18(19)20/h3-8,10,18H,9H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyKGYMJIUUVWWJIY-UHFFFAOYSA-N
MW364.35 g/mol
LogP3.44
Rot. Bonds7

About N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide

N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide (PubChem CID 33178137) has the molecular formula C18H18F2N2O4 and a molecular weight of 364.35 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide
PubChem CID33178137
Molecular FormulaC18H18F2N2O4
Molecular Weight364.35 g/mol
Exact Mass364.12
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)Cc1ccc(OC(F)F)cc1
InChIInChI=1S/C18H18F2N2O4/c1-11(23)21-13-5-8-16(25-2)15(10-13)22-17(24)9-12-3-6-14(7-4-12)26-18(19)20/h3-8,10,18H,9H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyKGYMJIUUVWWJIY-UHFFFAOYSA-N
XLogP3.44
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.35
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide (CID 33178137) is N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide is COc1ccc(NC(C)=O)cc1NC(=O)Cc1ccc(OC(F)F)cc1.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide?
The InChIKey is KGYMJIUUVWWJIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O4/c1-11(23)21-13-5-8-16(25-2)15(10-13)22-17(24)9-12-3-6-14(7-4-12)26-18(19)20/h3-8,10,18H,9H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide has a molecular weight of 364.35 g/mol, XLogP of 3.44, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-[4-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 33178137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).