2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide

C17H17ClN2O5 — CID 18085792

IUPAC2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide
SMILESCOc1ccc(C(N)=O)c(OCC(=O)Nc2ccc(OC)c(Cl)c2)c1
InChIInChI=1S/C17H17ClN2O5/c1-23-11-4-5-12(17(19)22)15(8-11)25-9-16(21)20-10-3-6-14(24-2)13(18)7-10/h3-8H,9H2,1-2H3,(H2,19,22)(H,20,21)
InChIKeyQZLFXECSSSZFBK-UHFFFAOYSA-N
MW364.79 g/mol
LogP2.47
Rot. Bonds7

About 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide

2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide (PubChem CID 18085792) has the molecular formula C17H17ClN2O5 and a molecular weight of 364.79 g/mol. Its IUPAC name is 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide.

Molecular Properties

Compound Name2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide
PubChem CID18085792
Molecular FormulaC17H17ClN2O5
Molecular Weight364.79 g/mol
Exact Mass364.08
IUPAC Name2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide
SMILESCOc1ccc(C(N)=O)c(OCC(=O)Nc2ccc(OC)c(Cl)c2)c1
InChIInChI=1S/C17H17ClN2O5/c1-23-11-4-5-12(17(19)22)15(8-11)25-9-16(21)20-10-3-6-14(24-2)13(18)7-10/h3-8H,9H2,1-2H3,(H2,19,22)(H,20,21)
InChIKeyQZLFXECSSSZFBK-UHFFFAOYSA-N
XLogP2.47
TPSA99.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.79
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(3,4-difluoroanilino)-2-oxoethoxy]-4-methoxybenzamide
CID 18085786
2-[2-(2-chloro-4-methylanilino)-2-oxoethoxy]-4-methoxybenzamide
CID 18085795
N-(3-chloro-4-methoxyphenyl)-3-methoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]benzamide
CID 16546266
N-(3-chloro-4-methoxyphenyl)-2-(2-hydroxyphenoxy)acetamide
CID 2712886
2-chloro-5-[(2,4-dimethoxybenzoyl)amino]benzamide
CID 46570655
N-(3-chloro-4-methoxyphenyl)-2-(4-formylphenoxy)acetamide
CID 23409469
2-chloro-4-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]benzamide
CID 55611309
4-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-3-methoxybenzoic acid
CID 45397187
N-(3-chloro-4-methoxyphenyl)-2-(4-propanoylphenoxy)acetamide
CID 2709416
N-(3-chloro-4-methoxyphenyl)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
CID 7695455
N-(3-chloro-4-methoxyphenyl)-2-(2-ethylphenoxy)acetamide
CID 2709417
N-(3-chloro-4-methoxyphenyl)-3-(2,4-dimethoxyanilino)propanamide
CID 109038965

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide?
The IUPAC name of 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide (CID 18085792) is 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide.
What is the SMILES notation for 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide?
The canonical SMILES for 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide is COc1ccc(C(N)=O)c(OCC(=O)Nc2ccc(OC)c(Cl)c2)c1.
What is the InChIKey of 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide?
The InChIKey is QZLFXECSSSZFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClN2O5/c1-23-11-4-5-12(17(19)22)15(8-11)25-9-16(21)20-10-3-6-14(24-2)13(18)7-10/h3-8H,9H2,1-2H3,(H2,19,22)(H,20,21).
What are the key properties of 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide?
2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide has a molecular weight of 364.79 g/mol, XLogP of 2.47, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-chloro-4-methoxyanilino)-2-oxoethoxy]-4-methoxybenzamide is sourced from PubChem (CID 18085792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).