4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide

C18H19ClN2O3 — CID 17257106

IUPAC4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide
SMILESCCc1ccccc1NC(=O)c1cc(Cl)c(NC(C)=O)cc1OC
InChIInChI=1S/C18H19ClN2O3/c1-4-12-7-5-6-8-15(12)21-18(23)13-9-14(19)16(20-11(2)22)10-17(13)24-3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyWOLSSGREUHJFSQ-UHFFFAOYSA-N
MW346.81 g/mol
LogP4.12
Rot. Bonds5

About 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide

4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide (PubChem CID 17257106) has the molecular formula C18H19ClN2O3 and a molecular weight of 346.81 g/mol. Its IUPAC name is 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide.

Molecular Properties

Compound Name4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide
PubChem CID17257106
Molecular FormulaC18H19ClN2O3
Molecular Weight346.81 g/mol
Exact Mass346.11
IUPAC Name4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide
SMILESCCc1ccccc1NC(=O)c1cc(Cl)c(NC(C)=O)cc1OC
InChIInChI=1S/C18H19ClN2O3/c1-4-12-7-5-6-8-15(12)21-18(23)13-9-14(19)16(20-11(2)22)10-17(13)24-3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyWOLSSGREUHJFSQ-UHFFFAOYSA-N
XLogP4.12
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.81
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-5-chloro-2-methoxy-N-(2-methylphenyl)benzamide
CID 17257138
methyl 2-[(4-acetamido-5-chloro-2-methoxybenzoyl)amino]benzoate
CID 2988921
4-acetamido-5-chloro-N-(2,3-dichlorophenyl)-2-methoxybenzamide
CID 17257142
4-bromo-N-(2-ethylphenyl)-2-methoxybenzamide
CID 78987528
4-acetamido-5-chloro-2-methoxy-N-[(2R)-4-phenylbutan-2-yl]benzamide
CID 7356959
4-acetamido-5-chloro-N-(2-hydroxyethyl)-2-methoxybenzamide
CID 154085397
(2-fluorophenyl)methyl 4-acetamido-5-chloro-2-methoxybenzoate
CID 163338539
4-acetamido-5-chloro-2-methoxy-N-[(2R)-pentan-2-yl]benzamide
CID 7379277
[2-(2-ethylanilino)-2-oxoethyl] 2-[(2-chlorobenzoyl)amino]-4,5-dimethoxybenzoate
CID 42445888
N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide
CID 30804314
N-(2-chlorophenyl)-2,4,5-trimethoxybenzamide
CID 912702
4-benzamido-5-chloro-2-methoxybenzoic acid
CID 43405427

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide?
The IUPAC name of 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide (CID 17257106) is 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide.
What is the SMILES notation for 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide?
The canonical SMILES for 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide is CCc1ccccc1NC(=O)c1cc(Cl)c(NC(C)=O)cc1OC.
What is the InChIKey of 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide?
The InChIKey is WOLSSGREUHJFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O3/c1-4-12-7-5-6-8-15(12)21-18(23)13-9-14(19)16(20-11(2)22)10-17(13)24-3/h5-10H,4H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide?
4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide has a molecular weight of 346.81 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-5-chloro-N-(2-ethylphenyl)-2-methoxybenzamide is sourced from PubChem (CID 17257106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).