5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine

C24H52N2O2 — CID 154134188

IUPAC5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine
SMILESCN(C)CCCCCOCCCCCCCCCCOCCCCCN(C)C
InChIInChI=1S/C24H52N2O2/c1-25(2)19-13-11-17-23-27-21-15-9-7-5-6-8-10-16-22-28-24-18-12-14-20-26(3)4/h5-24H2,1-4H3
InChIKeyBLXUVCIQOXWQOW-UHFFFAOYSA-N
MW400.69 g/mol
LogP5.60
Rot. Bonds23

About 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine

5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine (PubChem CID 154134188) has the molecular formula C24H52N2O2 and a molecular weight of 400.69 g/mol. Its IUPAC name is 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine.

Molecular Properties

Compound Name5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine
PubChem CID154134188
Molecular FormulaC24H52N2O2
Molecular Weight400.69 g/mol
Exact Mass400.40
IUPAC Name5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine
SMILESCN(C)CCCCCOCCCCCCCCCCOCCCCCN(C)C
InChIInChI=1S/C24H52N2O2/c1-25(2)19-13-11-17-23-27-21-15-9-7-5-6-8-10-16-22-28-24-18-12-14-20-26(3)4/h5-24H2,1-4H3
InChIKeyBLXUVCIQOXWQOW-UHFFFAOYSA-N
XLogP5.60
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds23
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.69
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine
CID 71335921
6-[6-(dimethylamino)hexoxy]hexan-1-ol
CID 54275825
ethane;4-ethoxy-N,N-dimethylbutan-1-amine
CID 144519642
1-[5-(dimethylamino)pentoxy]propan-2-one;ethane
CID 142389541
1-[5-(dimethylamino)pentoxy]propan-2-one
CID 118445875
N,N,N',N'-tetramethylpentane-1,5-diamine;dihydrobromide
CID 173097999
3-(2-aminoethoxy)-N,N-dimethylpropan-1-amine
CID 56993773
3-[4-[3-(dimethylamino)propoxy]butoxy]-N-methylpropan-1-amine
CID 58806980
N,N,N',N'-tetramethylbutane-1,4-diamine;dihydrochloride
CID 20545505
N,N-dimethyldecan-1-amine;ruthenium
CID 158300226
potassium 2-[2-[3-(dimethylamino)propoxy]ethoxy]ethanolate
CID 159366457
20-[20-(diethylamino)icosoxy]-N,N-diethylicosan-1-amine
CID 87698049

Frequently Asked Questions

What is the IUPAC name of 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine?
The IUPAC name of 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine (CID 154134188) is 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine.
What is the SMILES notation for 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine?
The canonical SMILES for 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine is CN(C)CCCCCOCCCCCCCCCCOCCCCCN(C)C.
What is the InChIKey of 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine?
The InChIKey is BLXUVCIQOXWQOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52N2O2/c1-25(2)19-13-11-17-23-27-21-15-9-7-5-6-8-10-16-22-28-24-18-12-14-20-26(3)4/h5-24H2,1-4H3.
What are the key properties of 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine?
5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine has a molecular weight of 400.69 g/mol, XLogP of 5.60, 23 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine is sourced from PubChem (CID 154134188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).