2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide

C16H26N2O3 — CID 54829121

IUPAC2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide
SMILESCOCCCNCC(=O)Nc1ccccc1OCC(C)C
InChIInChI=1S/C16H26N2O3/c1-13(2)12-21-15-8-5-4-7-14(15)18-16(19)11-17-9-6-10-20-3/h4-5,7-8,13,17H,6,9-12H2,1-3H3,(H,18,19)
InChIKeyZXKLEHNSZODXQQ-UHFFFAOYSA-N
MW294.39 g/mol
LogP2.29
Rot. Bonds10

About 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide

2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide (PubChem CID 54829121) has the molecular formula C16H26N2O3 and a molecular weight of 294.39 g/mol. Its IUPAC name is 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide
PubChem CID54829121
Molecular FormulaC16H26N2O3
Molecular Weight294.39 g/mol
Exact Mass294.19
IUPAC Name2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide
SMILESCOCCCNCC(=O)Nc1ccccc1OCC(C)C
InChIInChI=1S/C16H26N2O3/c1-13(2)12-21-15-8-5-4-7-14(15)18-16(19)11-17-9-6-10-20-3/h4-5,7-8,13,17H,6,9-12H2,1-3H3,(H,18,19)
InChIKeyZXKLEHNSZODXQQ-UHFFFAOYSA-N
XLogP2.29
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide 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

2-(3-methoxypropylamino)-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 54829343
N-(3-methoxypropyl)-2-[2-(2-methylpropoxy)anilino]acetamide
CID 54824114
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214
N,N'-bis[2-(2-methylpropoxy)phenyl]hexanediamide
CID 17074524
N,N'-bis[2-(2-methylpropoxy)phenyl]nonanediamide
CID 17074526
2-(2-methoxyethylamino)-N-(2-propan-2-yloxyphenyl)acetamide;hydrochloride
CID 119714872
N-(2-ethoxyphenyl)-2-(3-methylbutylamino)acetamide
CID 109005835
4-hydroxy-N-[2-(2-methylpropoxy)phenyl]butanamide
CID 79203312
4-(methylamino)-N-[2-(2-methylpropoxy)phenyl]butanamide;hydrochloride
CID 119714822
2-(3,4-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54811574
2-(2,3-dimethylanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54815991
N-(2-methoxyphenyl)-2-(3-propoxypropylamino)acetamide
CID 82944054

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The IUPAC name of 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide (CID 54829121) is 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide.
What is the SMILES notation for 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The canonical SMILES for 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide is COCCCNCC(=O)Nc1ccccc1OCC(C)C.
What is the InChIKey of 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
The InChIKey is ZXKLEHNSZODXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-13(2)12-21-15-8-5-4-7-14(15)18-16(19)11-17-9-6-10-20-3/h4-5,7-8,13,17H,6,9-12H2,1-3H3,(H,18,19).
What are the key properties of 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide?
2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide has a molecular weight of 294.39 g/mol, XLogP of 2.29, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropylamino)-N-[2-(2-methylpropoxy)phenyl]acetamide is sourced from PubChem (CID 54829121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).