3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide

C19H23ClN2O3 — CID 109039788

IUPAC3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1NC(=O)CCNc1cc(C)c(Cl)cc1OC
InChIInChI=1S/C19H23ClN2O3/c1-4-25-17-8-6-5-7-15(17)22-19(23)9-10-21-16-11-13(2)14(20)12-18(16)24-3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23)
InChIKeyAMCGDJAWRYQVTD-UHFFFAOYSA-N
MW362.86 g/mol
LogP4.50
Rot. Bonds8

About 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide

3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide (PubChem CID 109039788) has the molecular formula C19H23ClN2O3 and a molecular weight of 362.86 g/mol. Its IUPAC name is 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide
PubChem CID109039788
Molecular FormulaC19H23ClN2O3
Molecular Weight362.86 g/mol
Exact Mass362.14
IUPAC Name3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide
SMILESCCOc1ccccc1NC(=O)CCNc1cc(C)c(Cl)cc1OC
InChIInChI=1S/C19H23ClN2O3/c1-4-25-17-8-6-5-7-15(17)22-19(23)9-10-21-16-11-13(2)14(20)12-18(16)24-3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23)
InChIKeyAMCGDJAWRYQVTD-UHFFFAOYSA-N
XLogP4.50
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 ≤ 54.50
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-(2-ethoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47882363
3-(4-chloro-2-methoxy-5-methylanilino)-N-(5-chloro-2-methylphenyl)propanamide
CID 109038425
3-(2,4-dimethoxyanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039741
3-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)propanamide
CID 109035537
3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chlorophenyl)propanamide
CID 109038015
3-(4-chloro-2-methoxy-5-methylanilino)-N-(3-chloro-4-methoxyphenyl)propanamide
CID 109039005
N-(4-chloro-2-methoxy-5-methylphenyl)-3-(2,5-dichloroanilino)propanamide
CID 109042672
3-(2-ethoxyanilino)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 109039839
3-(4-chloro-2-methoxy-5-methylanilino)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 109025345
3-(4-chloro-2-methoxy-5-methylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 109036891
2-(4-chloro-2-methoxy-5-methylanilino)-N-(2-phenoxyphenyl)acetamide
CID 109011102

Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide?
The IUPAC name of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide (CID 109039788) is 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide.
What is the SMILES notation for 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide?
The canonical SMILES for 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide is CCOc1ccccc1NC(=O)CCNc1cc(C)c(Cl)cc1OC.
What is the InChIKey of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide?
The InChIKey is AMCGDJAWRYQVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O3/c1-4-25-17-8-6-5-7-15(17)22-19(23)9-10-21-16-11-13(2)14(20)12-18(16)24-3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23).
What are the key properties of 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide?
3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide has a molecular weight of 362.86 g/mol, XLogP of 4.50, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-2-methoxy-5-methylanilino)-N-(2-ethoxyphenyl)propanamide is sourced from PubChem (CID 109039788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).