2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide

C15H23N3O3 — CID 43112708

IUPAC2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide
SMILESCOCCCNC(=O)C(C)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H23N3O3/c1-11(15(20)16-9-4-10-21-3)17-13-5-7-14(8-6-13)18-12(2)19/h5-8,11,17H,4,9-10H2,1-3H3,(H,16,20)(H,18,19)
InChIKeyQIJSWTLSTMLWOK-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.60
Rot. Bonds8

About 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide

2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide (PubChem CID 43112708) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide.

Molecular Properties

Compound Name2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide
PubChem CID43112708
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide
SMILESCOCCCNC(=O)C(C)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H23N3O3/c1-11(15(20)16-9-4-10-21-3)17-13-5-7-14(8-6-13)18-12(2)19/h5-8,11,17H,4,9-10H2,1-3H3,(H,16,20)(H,18,19)
InChIKeyQIJSWTLSTMLWOK-UHFFFAOYSA-N
XLogP1.60
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide
CID 43123159
2-(3,5-dichloro-4-fluoroanilino)-N-(3-methoxypropyl)propanamide
CID 103579856
4-acetamido-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 134029617
N-(3-methoxypropyl)-N'-(4-propan-2-ylphenyl)oxamide
CID 624152
ethyl N-[4-[[1-oxo-1-(pentylamino)propan-2-yl]amino]phenyl]carbamate
CID 60542297
2-(4-acetamidoanilino)-N-(ethylcarbamoyl)propanamide
CID 43083279
2-hydroxy-N-(3-methoxypropyl)propanamide
CID 43558715
N-butyl-2-(4-propoxyanilino)propanamide
CID 62329025
2-(4-acetamido-N-acetylanilino)-N-(3-methoxypropyl)acetamide
CID 113175889
2-(2,4-dibromoanilino)-N-(3-methoxypropyl)propanamide
CID 61473681
2-[(2,5-dimethylpyrrol-1-yl)amino]-N-(3-methoxypropyl)propanamide
CID 79099906
2-(3-fluoro-4-methylanilino)-N-(2-methoxyethyl)propanamide
CID 43087306

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide?
The IUPAC name of 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide (CID 43112708) is 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide.
What is the SMILES notation for 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide?
The canonical SMILES for 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide is COCCCNC(=O)C(C)Nc1ccc(NC(C)=O)cc1.
What is the InChIKey of 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide?
The InChIKey is QIJSWTLSTMLWOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-11(15(20)16-9-4-10-21-3)17-13-5-7-14(8-6-13)18-12(2)19/h5-8,11,17H,4,9-10H2,1-3H3,(H,16,20)(H,18,19).
What are the key properties of 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide?
2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide has a molecular weight of 293.37 g/mol, XLogP of 1.60, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide is sourced from PubChem (CID 43112708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).