2-(ethylamino)-N-(4-methoxybutyl)benzamide

C14H22N2O2 — CID 55047330

IUPAC2-(ethylamino)-N-(4-methoxybutyl)benzamide
SMILESCCNc1ccccc1C(=O)NCCCCOC
InChIInChI=1S/C14H22N2O2/c1-3-15-13-9-5-4-8-12(13)14(17)16-10-6-7-11-18-2/h4-5,8-9,15H,3,6-7,10-11H2,1-2H3,(H,16,17)
InChIKeyVBKXUJAAGZYIGI-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.27
Rot. Bonds8

About 2-(ethylamino)-N-(4-methoxybutyl)benzamide

2-(ethylamino)-N-(4-methoxybutyl)benzamide (PubChem CID 55047330) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-(ethylamino)-N-(4-methoxybutyl)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(4-methoxybutyl)benzamide
PubChem CID55047330
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-(ethylamino)-N-(4-methoxybutyl)benzamide
SMILESCCNc1ccccc1C(=O)NCCCCOC
InChIInChI=1S/C14H22N2O2/c1-3-15-13-9-5-4-8-12(13)14(17)16-10-6-7-11-18-2/h4-5,8-9,15H,3,6-7,10-11H2,1-2H3,(H,16,17)
InChIKeyVBKXUJAAGZYIGI-UHFFFAOYSA-N
XLogP2.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(ethylamino)-N-(4-methoxybutyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-aminobutyl)-2-(ethylamino)benzamide
CID 55178434
2-(ethylamino)-N-(2-propan-2-yloxyethyl)benzamide
CID 113450457
2-(ethylamino)-N-(3-methoxy-2-methylpropyl)benzamide
CID 62175521
N,N'-bis[2-(3-methoxypropylcarbamoyl)phenyl]hexanediamide
CID 17148582
N-[3-(diethylamino)-3-oxopropyl]-2-(ethylamino)benzamide
CID 63107836
4-(ethylamino)-N-(4-methoxybutyl)benzamide
CID 62175950
N-(3-hydroxypropyl)-2-(propylamino)benzamide
CID 55178627
2-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]benzamide
CID 62185963
2-(ethylamino)-N-[2-(4-hydroxyphenyl)ethyl]benzamide
CID 62180979
2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
CID 2967457
1-N,2-N-bis(2-methoxyethyl)benzene-1,2-dicarboxamide
CID 4574574
ethyl 2-[[2-(ethylamino)benzoyl]amino]acetate
CID 55177471

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(4-methoxybutyl)benzamide?
The IUPAC name of 2-(ethylamino)-N-(4-methoxybutyl)benzamide (CID 55047330) is 2-(ethylamino)-N-(4-methoxybutyl)benzamide.
What is the SMILES notation for 2-(ethylamino)-N-(4-methoxybutyl)benzamide?
The canonical SMILES for 2-(ethylamino)-N-(4-methoxybutyl)benzamide is CCNc1ccccc1C(=O)NCCCCOC.
What is the InChIKey of 2-(ethylamino)-N-(4-methoxybutyl)benzamide?
The InChIKey is VBKXUJAAGZYIGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-3-15-13-9-5-4-8-12(13)14(17)16-10-6-7-11-18-2/h4-5,8-9,15H,3,6-7,10-11H2,1-2H3,(H,16,17).
What are the key properties of 2-(ethylamino)-N-(4-methoxybutyl)benzamide?
2-(ethylamino)-N-(4-methoxybutyl)benzamide has a molecular weight of 250.34 g/mol, XLogP of 2.27, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(4-methoxybutyl)benzamide is sourced from PubChem (CID 55047330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).