N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide

C15H25N3O3 — CID 81037444

IUPACN-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide
SMILESCCOCCN(C)C(C)C(=O)Nc1ccc(N)cc1OC
InChIInChI=1S/C15H25N3O3/c1-5-21-9-8-18(3)11(2)15(19)17-13-7-6-12(16)10-14(13)20-4/h6-7,10-11H,5,8-9,16H2,1-4H3,(H,17,19)
InChIKeyWHDDRKQCLHXEMD-UHFFFAOYSA-N
MW295.38 g/mol
LogP1.57
Rot. Bonds8

About N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide

N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide (PubChem CID 81037444) has the molecular formula C15H25N3O3 and a molecular weight of 295.38 g/mol. Its IUPAC name is N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide.

Molecular Properties

Compound NameN-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide
PubChem CID81037444
Molecular FormulaC15H25N3O3
Molecular Weight295.38 g/mol
Exact Mass295.19
IUPAC NameN-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide
SMILESCCOCCN(C)C(C)C(=O)Nc1ccc(N)cc1OC
InChIInChI=1S/C15H25N3O3/c1-5-21-9-8-18(3)11(2)15(19)17-13-7-6-12(16)10-14(13)20-4/h6-7,10-11H,5,8-9,16H2,1-4H3,(H,17,19)
InChIKeyWHDDRKQCLHXEMD-UHFFFAOYSA-N
XLogP1.57
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-2-methoxyphenyl)-2-[methyl(2-methylpropyl)amino]propanamide
CID 43271750
N-(4-amino-2-methoxyphenyl)-2-[2-cyanoethyl(methyl)amino]propanamide
CID 43186146
N-(4-amino-2-methoxyphenyl)-2-[(2-amino-2-oxoethyl)-methylamino]propanamide
CID 43373847
N-(2-amino-4-chlorophenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide
CID 81053275
N-(4-amino-2-chlorophenyl)-2-[2-methoxyethyl(methyl)amino]propanamide
CID 61429181
N-(4-amino-2-methoxyphenyl)-2-[cyclopropyl(methyl)amino]propanamide
CID 43264583
N-(4-amino-2-methoxyphenyl)-2-[butyl(methyl)amino]butanamide
CID 82224746
N-(4-amino-2-methylphenyl)-2-[3-methoxypropyl(methyl)amino]propanamide
CID 62983726
N-(5-amino-2-methoxyphenyl)-2-[cyclopropylmethyl(methyl)amino]propanamide
CID 60984612
N-(5-amino-2-methoxyphenyl)-2-[1-methoxypropan-2-yl(methyl)amino]propanamide
CID 61449940
N-(4-amino-2-methoxyphenyl)-4-[butan-2-yl(methyl)amino]butanamide
CID 43272523
N-(4-amino-2-methoxyphenyl)-2-(2-ethoxyethoxy)benzamide
CID 54852699

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide?
The IUPAC name of N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide (CID 81037444) is N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide.
What is the SMILES notation for N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide?
The canonical SMILES for N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide is CCOCCN(C)C(C)C(=O)Nc1ccc(N)cc1OC.
What is the InChIKey of N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide?
The InChIKey is WHDDRKQCLHXEMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O3/c1-5-21-9-8-18(3)11(2)15(19)17-13-7-6-12(16)10-14(13)20-4/h6-7,10-11H,5,8-9,16H2,1-4H3,(H,17,19).
What are the key properties of N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide?
N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide has a molecular weight of 295.38 g/mol, XLogP of 1.57, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methoxyphenyl)-2-[2-ethoxyethyl(methyl)amino]propanamide is sourced from PubChem (CID 81037444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).