6-[6-(dimethylamino)hexoxy]hexan-1-ol

C14H31NO2 — CID 54275825

IUPAC6-[6-(dimethylamino)hexoxy]hexan-1-ol
SMILESCN(C)CCCCCCOCCCCCCO
InChIInChI=1S/C14H31NO2/c1-15(2)11-7-3-5-9-13-17-14-10-6-4-8-12-16/h16H,3-14H2,1-2H3
InChIKeyZUYHNXTZADOZGF-UHFFFAOYSA-N
MW245.41 g/mol
LogP2.68
Rot. Bonds13

About 6-[6-(dimethylamino)hexoxy]hexan-1-ol

6-[6-(dimethylamino)hexoxy]hexan-1-ol (PubChem CID 54275825) has the molecular formula C14H31NO2 and a molecular weight of 245.41 g/mol. Its IUPAC name is 6-[6-(dimethylamino)hexoxy]hexan-1-ol.

Molecular Properties

Compound Name6-[6-(dimethylamino)hexoxy]hexan-1-ol
PubChem CID54275825
Molecular FormulaC14H31NO2
Molecular Weight245.41 g/mol
Exact Mass245.24
IUPAC Name6-[6-(dimethylamino)hexoxy]hexan-1-ol
SMILESCN(C)CCCCCCOCCCCCCO
InChIInChI=1S/C14H31NO2/c1-15(2)11-7-3-5-9-13-17-14-10-6-4-8-12-16/h16H,3-14H2,1-2H3
InChIKeyZUYHNXTZADOZGF-UHFFFAOYSA-N
XLogP2.68
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.41
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-[6-(dimethylamino)hexoxy]hexan-1-ol 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

5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine
CID 154134188
6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine
CID 71335921
4-[6-(3-hydroxypropoxy)hexoxy]butan-1-ol
CID 90752305
ethane-1,2-diol;4-[4-(4-hydroxybutoxy)butoxy]butan-1-ol
CID 87472116
5-octoxypentan-1-ol
CID 22407981
9-nonoxynonan-1-ol
CID 57318642
1-[5-(dimethylamino)pentoxy]propan-2-one;ethane
CID 142389541
1-[5-(dimethylamino)pentoxy]propan-2-one
CID 118445875
8-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]octan-1-ol
CID 134883516
5-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]pentan-1-ol
CID 87403032
12-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]dodecan-1-ol
CID 134883585
3-[3-[3-[3-[3-[3-[3-[3-[3-[6-[3-[3-[3-[3-[3-[3-[3-[3-[3-(3-hydroxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]hexoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 59025207

Frequently Asked Questions

What is the IUPAC name of 6-[6-(dimethylamino)hexoxy]hexan-1-ol?
The IUPAC name of 6-[6-(dimethylamino)hexoxy]hexan-1-ol (CID 54275825) is 6-[6-(dimethylamino)hexoxy]hexan-1-ol.
What is the SMILES notation for 6-[6-(dimethylamino)hexoxy]hexan-1-ol?
The canonical SMILES for 6-[6-(dimethylamino)hexoxy]hexan-1-ol is CN(C)CCCCCCOCCCCCCO.
What is the InChIKey of 6-[6-(dimethylamino)hexoxy]hexan-1-ol?
The InChIKey is ZUYHNXTZADOZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO2/c1-15(2)11-7-3-5-9-13-17-14-10-6-4-8-12-16/h16H,3-14H2,1-2H3.
What are the key properties of 6-[6-(dimethylamino)hexoxy]hexan-1-ol?
6-[6-(dimethylamino)hexoxy]hexan-1-ol has a molecular weight of 245.41 g/mol, XLogP of 2.68, 13 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(dimethylamino)hexoxy]hexan-1-ol is sourced from PubChem (CID 54275825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).