2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide

C17H28N4O2 — CID 3229652

IUPAC2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCN(C)CCCNCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C17H28N4O2/c1-20(2)9-5-8-18-14-17(22)19-15-6-3-4-7-16(15)21-10-12-23-13-11-21/h3-4,6-7,18H,5,8-14H2,1-2H3,(H,19,22)
InChIKeyCFPLMZITFMFDJE-UHFFFAOYSA-N
MW320.44 g/mol
LogP1.00
Rot. Bonds8

About 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide

2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 3229652) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID3229652
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Name2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCN(C)CCCNCC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C17H28N4O2/c1-20(2)9-5-8-18-14-17(22)19-15-6-3-4-7-16(15)21-10-12-23-13-11-21/h3-4,6-7,18H,5,8-14H2,1-2H3,(H,19,22)
InChIKeyCFPLMZITFMFDJE-UHFFFAOYSA-N
XLogP1.00
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(dimethylamino)propyl]-N'-(2-morpholin-4-ylphenyl)oxamide
CID 108524772
2-(3-ethoxypropylamino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 645222
2-(3-methylbutylamino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109005860
2-[(2-methylphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 108996603
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
2-(2,6-dimethylanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109007545
N-(3,4-dimethylphenyl)-N'-(2-morpholin-4-ylphenyl)propanediamide
CID 108953647
N-(2-bromophenyl)-2-[3-(dimethylamino)propylamino]acetamide
CID 28583681
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
2-[(3-methylphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 108996829
N',N'-diethyl-N-(2-morpholin-4-ylphenyl)propanediamide
CID 108951131
2-(2-bromoanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109010619

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide (CID 3229652) is 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide is CN(C)CCCNCC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is CFPLMZITFMFDJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2/c1-20(2)9-5-8-18-14-17(22)19-15-6-3-4-7-16(15)21-10-12-23-13-11-21/h3-4,6-7,18H,5,8-14H2,1-2H3,(H,19,22).
What are the key properties of 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide?
2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 320.44 g/mol, XLogP of 1.00, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)propylamino]-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 3229652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).