N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide

C17H19ClN2O2 — CID 9101959

IUPACN-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide
SMILESCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C17H19ClN2O2/c1-3-22-16-10-5-4-8-15(16)19-11-17(21)20-14-9-6-7-13(18)12(14)2/h4-10,19H,3,11H2,1-2H3,(H,20,21)
InChIKeyJDBRUXAMKVOMLG-UHFFFAOYSA-N
MW318.80 g/mol
LogP4.10
Rot. Bonds6

About N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide

N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide (PubChem CID 9101959) has the molecular formula C17H19ClN2O2 and a molecular weight of 318.80 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide
PubChem CID9101959
Molecular FormulaC17H19ClN2O2
Molecular Weight318.80 g/mol
Exact Mass318.11
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide
SMILESCCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1C
InChIInChI=1S/C17H19ClN2O2/c1-3-22-16-10-5-4-8-15(16)19-11-17(21)20-14-9-6-7-13(18)12(14)2/h4-10,19H,3,11H2,1-2H3,(H,20,21)
InChIKeyJDBRUXAMKVOMLG-UHFFFAOYSA-N
XLogP4.10
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.80
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955086
N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827342
N-[3-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 38773224
2-(3-chloro-2-methylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54812960
N-(3-chloro-2-methylphenyl)-2-ethoxybenzamide
CID 723566
N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 33162844
N-(3-chloro-2-methylphenyl)-2-(2-fluoroanilino)acetamide
CID 2604427
2-(3-chloro-2-methylanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54812884
N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827691
2-(N-acetyl-2-ethoxyanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 113173786
2-(5-chloro-2-methylanilino)-N-(2-ethoxyphenyl)acetamide
CID 9102968

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide (CID 9101959) is N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide is CCOc1ccccc1NCC(=O)Nc1cccc(Cl)c1C.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide?
The InChIKey is JDBRUXAMKVOMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O2/c1-3-22-16-10-5-4-8-15(16)19-11-17(21)20-14-9-6-7-13(18)12(14)2/h4-10,19H,3,11H2,1-2H3,(H,20,21).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide?
N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide has a molecular weight of 318.80 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide is sourced from PubChem (CID 9101959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).