N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide

C18H20ClNO5 — CID 7695455

IUPACN-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
SMILESCOc1ccc(NC(=O)COc2c(OC)cc(C)cc2OC)cc1Cl
InChIInChI=1S/C18H20ClNO5/c1-11-7-15(23-3)18(16(8-11)24-4)25-10-17(21)20-12-5-6-14(22-2)13(19)9-12/h5-9H,10H2,1-4H3,(H,20,21)
InChIKeyVOFFSUOFVKVSCC-UHFFFAOYSA-N
MW365.81 g/mol
LogP3.69
Rot. Bonds7

About N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide

N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide (PubChem CID 7695455) has the molecular formula C18H20ClNO5 and a molecular weight of 365.81 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
PubChem CID7695455
Molecular FormulaC18H20ClNO5
Molecular Weight365.81 g/mol
Exact Mass365.10
IUPAC NameN-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
SMILESCOc1ccc(NC(=O)COc2c(OC)cc(C)cc2OC)cc1Cl
InChIInChI=1S/C18H20ClNO5/c1-11-7-15(23-3)18(16(8-11)24-4)25-10-17(21)20-12-5-6-14(22-2)13(19)9-12/h5-9H,10H2,1-4H3,(H,20,21)
InChIKeyVOFFSUOFVKVSCC-UHFFFAOYSA-N
XLogP3.69
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.81
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide (CID 7695455) is N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide is COc1ccc(NC(=O)COc2c(OC)cc(C)cc2OC)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide?
The InChIKey is VOFFSUOFVKVSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO5/c1-11-7-15(23-3)18(16(8-11)24-4)25-10-17(21)20-12-5-6-14(22-2)13(19)9-12/h5-9H,10H2,1-4H3,(H,20,21).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide?
N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide has a molecular weight of 365.81 g/mol, XLogP of 3.69, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide is sourced from PubChem (CID 7695455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).