N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide

C18H19ClF2N2O3 — CID 33184219

IUPACN-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN(C)Cc1ccccc1OC(F)F
InChIInChI=1S/C18H19ClF2N2O3/c1-23(10-12-5-3-4-6-15(12)26-18(20)21)11-17(24)22-14-9-13(19)7-8-16(14)25-2/h3-9,18H,10-11H2,1-2H3,(H,22,24)
InChIKeyOZIRESWHVPXUIR-UHFFFAOYSA-N
MW384.81 g/mol
LogP4.02
Rot. Bonds8

About N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide

N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide (PubChem CID 33184219) has the molecular formula C18H19ClF2N2O3 and a molecular weight of 384.81 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide
PubChem CID33184219
Molecular FormulaC18H19ClF2N2O3
Molecular Weight384.81 g/mol
Exact Mass384.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide
SMILESCOc1ccc(Cl)cc1NC(=O)CN(C)Cc1ccccc1OC(F)F
InChIInChI=1S/C18H19ClF2N2O3/c1-23(10-12-5-3-4-6-15(12)26-18(20)21)11-17(24)22-14-9-13(19)7-8-16(14)25-2/h3-9,18H,10-11H2,1-2H3,(H,22,24)
InChIKeyOZIRESWHVPXUIR-UHFFFAOYSA-N
XLogP4.02
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.81
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide (CID 33184219) is N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide is COc1ccc(Cl)cc1NC(=O)CN(C)Cc1ccccc1OC(F)F.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide?
The InChIKey is OZIRESWHVPXUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClF2N2O3/c1-23(10-12-5-3-4-6-15(12)26-18(20)21)11-17(24)22-14-9-13(19)7-8-16(14)25-2/h3-9,18H,10-11H2,1-2H3,(H,22,24).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide?
N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide has a molecular weight of 384.81 g/mol, XLogP of 4.02, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-[[2-(difluoromethoxy)phenyl]methyl-methylamino]acetamide is sourced from PubChem (CID 33184219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).