N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide

C19H24N2O4 — CID 54820345

IUPACN-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide
SMILESCCCOc1ccc(NCC(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C19H24N2O4/c1-4-11-25-15-7-5-14(6-8-15)20-13-19(22)21-17-12-16(23-2)9-10-18(17)24-3/h5-10,12,20H,4,11,13H2,1-3H3,(H,21,22)
InChIKeyDVLSFUIXQDNGNH-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.54
Rot. Bonds9

About N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide

N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide (PubChem CID 54820345) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide
PubChem CID54820345
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC NameN-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide
SMILESCCCOc1ccc(NCC(=O)Nc2cc(OC)ccc2OC)cc1
InChIInChI=1S/C19H24N2O4/c1-4-11-25-15-7-5-14(6-8-15)20-13-19(22)21-17-12-16(23-2)9-10-18(17)24-3/h5-10,12,20H,4,11,13H2,1-3H3,(H,21,22)
InChIKeyDVLSFUIXQDNGNH-UHFFFAOYSA-N
XLogP3.54
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

butyl 4-[[2-(2,5-dimethoxyanilino)-2-oxoethyl]amino]benzoate
CID 9084168
2-[4-(difluoromethoxy)anilino]-N-(2,5-dimethoxyphenyl)acetamide
CID 36585879
2-(4-propoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54820383
N-(2,5-dimethoxyphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 51178370
4-[[2-(2,5-dimethoxyanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 54840532
N-(2,5-dimethoxyphenyl)-2-[2-(4-propoxyphenoxy)ethylsulfanyl]acetamide
CID 31547774
2-[4-(diethylsulfamoyl)anilino]-N-(2,5-dimethoxyphenyl)acetamide
CID 9084037
2-(3-bromo-4-methylanilino)-N-(2,5-dimethoxyphenyl)acetamide
CID 109008943
N-(2,5-dimethoxyphenyl)-3-(4-methoxyphenoxy)propanamide
CID 17034633
N-[2-(2-phenoxyethoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820282
2-(2,5-dimethoxyanilino)-N-[2-(2-phenoxyethoxy)phenyl]acetamide
CID 54814166
N-(2,5-dimethoxyphenyl)-2-(4-methoxyphenoxy)acetamide
CID 676177

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide (CID 54820345) is N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide is CCCOc1ccc(NCC(=O)Nc2cc(OC)ccc2OC)cc1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide?
The InChIKey is DVLSFUIXQDNGNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-4-11-25-15-7-5-14(6-8-15)20-13-19(22)21-17-12-16(23-2)9-10-18(17)24-3/h5-10,12,20H,4,11,13H2,1-3H3,(H,21,22).
What are the key properties of N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide?
N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide has a molecular weight of 344.41 g/mol, XLogP of 3.54, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-2-(4-propoxyanilino)acetamide is sourced from PubChem (CID 54820345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).