2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide

C18H20ClNO4 — CID 3657024

IUPAC2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(OC)c(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c1
InChIInChI=1S/C18H20ClNO4/c1-18(2,24-13-7-5-12(19)6-8-13)17(21)20-15-11-14(22-3)9-10-16(15)23-4/h5-11H,1-4H3,(H,20,21)
InChIKeyFLLZSPSBZJYGRY-UHFFFAOYSA-N
MW349.81 g/mol
LogP4.15
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide

2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide (PubChem CID 3657024) has the molecular formula C18H20ClNO4 and a molecular weight of 349.81 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide
PubChem CID3657024
Molecular FormulaC18H20ClNO4
Molecular Weight349.81 g/mol
Exact Mass349.11
IUPAC Name2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide
SMILESCOc1ccc(OC)c(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c1
InChIInChI=1S/C18H20ClNO4/c1-18(2,24-13-7-5-12(19)6-8-13)17(21)20-15-11-14(22-3)9-10-16(15)23-4/h5-11H,1-4H3,(H,20,21)
InChIKeyFLLZSPSBZJYGRY-UHFFFAOYSA-N
XLogP4.15
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.81
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-amino-2-methoxyphenyl)-2-(4-chlorophenoxy)-2-methylpropanamide
CID 50878617
3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-4-methoxybenzoic acid
CID 28677113
2-(4-chlorophenoxy)-N-(3,5-dimethoxyphenyl)-2-methylpropanamide
CID 848261
2-(4-chlorophenoxy)-N-(4-methoxy-2-nitrophenyl)-2-methylpropanamide
CID 2934377
2-(4-chlorophenoxy)-N-[2-methoxy-5-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-2-methylpropanamide
CID 30307954
2-(4-chlorophenoxy)-2-methyl-N-(2-methylphenyl)propanamide
CID 2184934
N-(2,5-dimethoxyphenyl)-N'-(4-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969408
2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)propanamide
CID 4943920
N-(2,5-dimethoxyphenyl)-2-methyl-2-phenylpropanamide
CID 13309485
1-(4-chlorophenyl)-3-(2,5-dimethoxyanilino)but-2-en-1-one
CID 799459
2-(4-chlorophenoxy)-N-(4-iodo-2-methylphenyl)-2-methylpropanamide
CID 1257164
N-[2-(4-chlorobenzoyl)-5-methoxyphenyl]-2,2-dimethylpropanamide
CID 135058493

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide (CID 3657024) is 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide is COc1ccc(OC)c(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide?
The InChIKey is FLLZSPSBZJYGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO4/c1-18(2,24-13-7-5-12(19)6-8-13)17(21)20-15-11-14(22-3)9-10-16(15)23-4/h5-11H,1-4H3,(H,20,21).
What are the key properties of 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide?
2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide has a molecular weight of 349.81 g/mol, XLogP of 4.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(2,5-dimethoxyphenyl)-2-methylpropanamide is sourced from PubChem (CID 3657024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).