3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide

C19H24N2O4 — CID 109031059

IUPAC3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
SMILESCOc1ccc(OCCNC(=O)CCNc2cccc(OC)c2)cc1
InChIInChI=1S/C19H24N2O4/c1-23-16-6-8-17(9-7-16)25-13-12-21-19(22)10-11-20-15-4-3-5-18(14-15)24-2/h3-9,14,20H,10-13H2,1-2H3,(H,21,22)
InChIKeyIQZARAPNCRQYPM-UHFFFAOYSA-N
MW344.41 g/mol
LogP2.70
Rot. Bonds10

About 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide

3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide (PubChem CID 109031059) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide.

Molecular Properties

Compound Name3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
PubChem CID109031059
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
SMILESCOc1ccc(OCCNC(=O)CCNc2cccc(OC)c2)cc1
InChIInChI=1S/C19H24N2O4/c1-23-16-6-8-17(9-7-16)25-13-12-21-19(22)10-11-20-15-4-3-5-18(14-15)24-2/h3-9,14,20H,10-13H2,1-2H3,(H,21,22)
InChIKeyIQZARAPNCRQYPM-UHFFFAOYSA-N
XLogP2.70
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(3-fluoroanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
CID 109031072
N-butyl-3-(3-methoxyanilino)propanamide
CID 109012292
3-(4-bromoanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
CID 109031057
N-[2-(3-methoxyphenoxy)ethyl]-3-phenoxypropanamide
CID 113099798
N-[2-(4-fluorophenyl)ethyl]-3-(3-methoxyanilino)propanamide
CID 109025014
3-(2-methoxyethoxy)-N-[2-(4-methoxyphenoxy)ethyl]aniline
CID 54803079
N-[2-(4-methoxyphenoxy)ethyl]-2-[3-(trifluoromethyl)anilino]acetamide
CID 56540495
2-(3-methoxyanilino)-N-(2-methoxyethyl)acetamide
CID 39335252
N-[2-(3-methoxyphenoxy)ethyl]-2-(4-methoxyphenyl)acetamide
CID 46399940
N-[2-(4-methoxyphenoxy)ethyl]-3-propan-2-yloxyaniline
CID 54802827
N-[(4-chlorophenyl)methyl]-3-(3-methoxyanilino)propanamide
CID 109021721
3-(2-tert-butylanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide
CID 109031043

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide?
The IUPAC name of 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide (CID 109031059) is 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide.
What is the SMILES notation for 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide?
The canonical SMILES for 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide is COc1ccc(OCCNC(=O)CCNc2cccc(OC)c2)cc1.
What is the InChIKey of 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide?
The InChIKey is IQZARAPNCRQYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-23-16-6-8-17(9-7-16)25-13-12-21-19(22)10-11-20-15-4-3-5-18(14-15)24-2/h3-9,14,20H,10-13H2,1-2H3,(H,21,22).
What are the key properties of 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide?
3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide has a molecular weight of 344.41 g/mol, XLogP of 2.70, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyanilino)-N-[2-(4-methoxyphenoxy)ethyl]propanamide is sourced from PubChem (CID 109031059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).