N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide

C15H25N3O2 — CID 63698404

IUPACN-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide
SMILESCCOCCN(CC)CC(=O)Nc1ccc(C)c(N)c1
InChIInChI=1S/C15H25N3O2/c1-4-18(8-9-20-5-2)11-15(19)17-13-7-6-12(3)14(16)10-13/h6-7,10H,4-5,8-9,11,16H2,1-3H3,(H,17,19)
InChIKeySUXUHYVCBNJGOJ-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.87
Rot. Bonds8

About N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide

N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide (PubChem CID 63698404) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide
PubChem CID63698404
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide
SMILESCCOCCN(CC)CC(=O)Nc1ccc(C)c(N)c1
InChIInChI=1S/C15H25N3O2/c1-4-18(8-9-20-5-2)11-15(19)17-13-7-6-12(3)14(16)10-13/h6-7,10H,4-5,8-9,11,16H2,1-3H3,(H,17,19)
InChIKeySUXUHYVCBNJGOJ-UHFFFAOYSA-N
XLogP1.87
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(3-amino-4-methylphenyl)-2-[2-cyanoethyl(ethyl)amino]acetamide
CID 54988249
N-(3-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
CID 43376006
N-(3-amino-4-methylphenyl)-2-[cyclopropylmethyl(ethyl)amino]acetamide
CID 63954898
N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
CID 61444928
N-(3,4-diaminophenyl)-2-(diethylamino)acetamide
CID 66593690
N-(3-amino-4-methoxyphenyl)-2-(diethylamino)acetamide;dihydrochloride
CID 119419045
N-(3-amino-4-methylphenyl)-2-[methyl(2-methylbutan-2-yl)amino]acetamide
CID 63983055
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
N-(3-chloro-4-methylphenyl)-2-[ethyl(3-hydroxypropyl)amino]acetamide
CID 115669605
N-(3-amino-4-fluorophenyl)-3-[2-ethoxyethyl(methyl)amino]propanamide
CID 81053508
N-(4-acetamidophenyl)-2-[[2-(3,4-dimethylanilino)-2-oxoethyl]-ethylamino]acetamide
CID 8779925
N-(3-amino-4-methylphenyl)-2-[cyclopentyl(methyl)amino]acetamide
CID 43375929

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide (CID 63698404) is N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide is CCOCCN(CC)CC(=O)Nc1ccc(C)c(N)c1.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide?
The InChIKey is SUXUHYVCBNJGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-4-18(8-9-20-5-2)11-15(19)17-13-7-6-12(3)14(16)10-13/h6-7,10H,4-5,8-9,11,16H2,1-3H3,(H,17,19).
What are the key properties of N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide?
N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide has a molecular weight of 279.38 g/mol, XLogP of 1.87, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide is sourced from PubChem (CID 63698404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).