2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide

C22H46N2O2 — CID 163653558

IUPAC2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide
SMILESCN(C)CC(=O)NCCCCCCCCCCCCCCCCCCO
InChIInChI=1S/C22H46N2O2/c1-24(2)21-22(26)23-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-25/h25H,3-21H2,1-2H3,(H,23,26)
InChIKeyIOGUSPMMZYIIPK-UHFFFAOYSA-N
MW370.62 g/mol
LogP4.90
Rot. Bonds20

About 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide

2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide (PubChem CID 163653558) has the molecular formula C22H46N2O2 and a molecular weight of 370.62 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide
PubChem CID163653558
Molecular FormulaC22H46N2O2
Molecular Weight370.62 g/mol
Exact Mass370.36
IUPAC Name2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide
SMILESCN(C)CC(=O)NCCCCCCCCCCCCCCCCCCO
InChIInChI=1S/C22H46N2O2/c1-24(2)21-22(26)23-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-25/h25H,3-21H2,1-2H3,(H,23,26)
InChIKeyIOGUSPMMZYIIPK-UHFFFAOYSA-N
XLogP4.90
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds20
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.62
LogP ≤ 54.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(dimethylamino)-N-(8-hydroxyoctyl)acetamide
CID 154671930
2-(dimethylamino)-N-octadecylacetamide;ethane
CID 90860669
3-(5-hydroxypentyl)-1,1-dimethylurea
CID 107302711
2-chloro-N-(8-hydroxyoctyl)acetamide;ethane
CID 142307280
4-[[2-(dimethylamino)acetyl]amino]-N,N-dimethylbutanamide
CID 166186517
3-[butyl(methyl)amino]-N-(5-hydroxypentyl)propanamide
CID 108795355
N-(4-hydroxybutyl)-2-(methylamino)acetamide
CID 106841932
N-(2-acetamidoethyl)-2-(dimethylamino)acetamide;ethane
CID 143571910
6-hydroxy-N-tetradecylhexanamide
CID 20542961
18-hydroxy-N-octadecyloctadecanamide
CID 10984479
2-(dimethylamino)-N-(3-propan-2-yloxypropyl)acetamide
CID 156560781
2-[5-hydroxypentyl(methyl)amino]-N-(3-phenylpropyl)acetamide
CID 107204085

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide (CID 163653558) is 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide is CN(C)CC(=O)NCCCCCCCCCCCCCCCCCCO.
What is the InChIKey of 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide?
The InChIKey is IOGUSPMMZYIIPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46N2O2/c1-24(2)21-22(26)23-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-25/h25H,3-21H2,1-2H3,(H,23,26).
What are the key properties of 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide?
2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide has a molecular weight of 370.62 g/mol, XLogP of 4.90, 20 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(18-hydroxyoctadecyl)acetamide is sourced from PubChem (CID 163653558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).