N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide

C19H23ClN2O3 — CID 109036248

IUPACN-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide
SMILESCCc1ccccc1NCCC(=O)Nc1cc(OC)c(Cl)cc1OC
InChIInChI=1S/C19H23ClN2O3/c1-4-13-7-5-6-8-15(13)21-10-9-19(23)22-16-12-17(24-2)14(20)11-18(16)25-3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23)
InChIKeyLFNHEMMLZRSTCI-UHFFFAOYSA-N
MW362.86 g/mol
LogP4.36
Rot. Bonds8

About N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide

N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide (PubChem CID 109036248) has the molecular formula C19H23ClN2O3 and a molecular weight of 362.86 g/mol. Its IUPAC name is N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide.

Molecular Properties

Compound NameN-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide
PubChem CID109036248
Molecular FormulaC19H23ClN2O3
Molecular Weight362.86 g/mol
Exact Mass362.14
IUPAC NameN-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide
SMILESCCc1ccccc1NCCC(=O)Nc1cc(OC)c(Cl)cc1OC
InChIInChI=1S/C19H23ClN2O3/c1-4-13-7-5-6-8-15(13)21-10-9-19(23)22-16-12-17(24-2)14(20)11-18(16)25-3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23)
InChIKeyLFNHEMMLZRSTCI-UHFFFAOYSA-N
XLogP4.36
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.86
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-chloro-2,5-dimethoxyanilino)-N-(2-methoxyphenyl)propanamide
CID 109039398
N-(4-chloro-2,5-dimethoxyphenyl)-3-(3-chloro-2-methylanilino)propanamide
CID 109038365
2-(4-chloro-2,5-dimethoxyanilino)-N-(2-ethylphenyl)acetamide
CID 109007659
3-(3-chloro-4-methoxyanilino)-N-(2-ethylphenyl)propanamide
CID 109036116
N-(4-chloro-2,5-dimethoxyphenyl)-3-(3-methylanilino)propanamide
CID 109034321
methyl 4-chloro-3-[3-(2-ethylanilino)propanoylamino]benzoate
CID 109036221
N-(4-chloro-2,5-dimethoxyphenyl)-2-[2-(diethylaminomethyl)anilino]acetamide
CID 55897928
3-(tert-butylamino)-N-(4-chloro-2,5-dimethoxyphenyl)propanamide
CID 60850759
3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039788
3-(4-chloro-2,5-dimethoxyanilino)-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 109024771
N-(5-chloro-2,4-dimethoxyphenyl)-3-[(2-phenylacetyl)amino]propanamide
CID 51310881
N-(3,5-dichlorophenyl)-3-(2-ethylanilino)propanamide
CID 109036245

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide?
The IUPAC name of N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide (CID 109036248) is N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide.
What is the SMILES notation for N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide?
The canonical SMILES for N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide is CCc1ccccc1NCCC(=O)Nc1cc(OC)c(Cl)cc1OC.
What is the InChIKey of N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide?
The InChIKey is LFNHEMMLZRSTCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3/c1-4-13-7-5-6-8-15(13)21-10-9-19(23)22-16-12-17(24-2)14(20)11-18(16)25-3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23).
What are the key properties of N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide?
N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide has a molecular weight of 362.86 g/mol, XLogP of 4.36, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2,5-dimethoxyphenyl)-3-(2-ethylanilino)propanamide is sourced from PubChem (CID 109036248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).