N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide

C15H24N2O3 — CID 43123159

IUPACN-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide
SMILESCOCCNC(=O)C(C)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O3/c1-11(2)20-14-7-5-13(6-8-14)17-12(3)15(18)16-9-10-19-4/h5-8,11-12,17H,9-10H2,1-4H3,(H,16,18)
InChIKeyBYBVPLRBTOSIKI-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.04
Rot. Bonds8

About N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide

N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide (PubChem CID 43123159) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide
PubChem CID43123159
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide
SMILESCOCCNC(=O)C(C)Nc1ccc(OC(C)C)cc1
InChIInChI=1S/C15H24N2O3/c1-11(2)20-14-7-5-13(6-8-14)17-12(3)15(18)16-9-10-19-4/h5-8,11-12,17H,9-10H2,1-4H3,(H,16,18)
InChIKeyBYBVPLRBTOSIKI-UHFFFAOYSA-N
XLogP2.04
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(ethylcarbamoyl)-2-(4-propan-2-yloxyanilino)propanamide
CID 43123150
2-(3-fluoro-4-methylanilino)-N-(2-methoxyethyl)propanamide
CID 43087306
2-(4-acetamidoanilino)-N-(3-methoxypropyl)propanamide
CID 43112708
2-(4-butan-2-yloxyanilino)-N-propylpropanamide
CID 3030788
N-pentan-2-yl-2-(4-propan-2-yloxyanilino)propanamide
CID 43123138
2-(4-bromo-3-fluoroanilino)-N-(2-methoxyethyl)propanamide
CID 65437332
3-N-(2-methoxyethyl)-5-N-(4-propan-2-yloxyphenyl)pyridine-3,5-dicarboxamide
CID 109103509
N-(1-methoxypropan-2-yl)-4-propan-2-yloxyaniline
CID 62535634
[2-(2-methoxyethylamino)-2-oxoethyl] 4-propan-2-yloxybenzoate
CID 2603418
N-(2-methoxyethyl)-2-(4-methyl-3-nitroanilino)propanamide
CID 115573855
2-N-(2-methoxyethyl)-4-N-(4-propan-2-yloxyphenyl)pyridine-2,4-dicarboxamide
CID 109082428
N-(2-methoxyethyl)-2-[2-(4-methoxyphenyl)ethylamino]propanamide
CID 43087093

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide?
The IUPAC name of N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide (CID 43123159) is N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide?
The canonical SMILES for N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide is COCCNC(=O)C(C)Nc1ccc(OC(C)C)cc1.
What is the InChIKey of N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide?
The InChIKey is BYBVPLRBTOSIKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)20-14-7-5-13(6-8-14)17-12(3)15(18)16-9-10-19-4/h5-8,11-12,17H,9-10H2,1-4H3,(H,16,18).
What are the key properties of N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide?
N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide has a molecular weight of 280.37 g/mol, XLogP of 2.04, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-(4-propan-2-yloxyanilino)propanamide is sourced from PubChem (CID 43123159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).