6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine

C13H30N2O — CID 71335921

IUPAC6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine
SMILESCN(C)CCCCCCOCCCN(C)C
InChIInChI=1S/C13H30N2O/c1-14(2)10-7-5-6-8-12-16-13-9-11-15(3)4/h5-13H2,1-4H3
InChIKeyXZWHVGHSTRWWKX-UHFFFAOYSA-N
MW230.40 g/mol
LogP2.08
Rot. Bonds11

About 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine

6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine (PubChem CID 71335921) has the molecular formula C13H30N2O and a molecular weight of 230.40 g/mol. Its IUPAC name is 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine.

Molecular Properties

Compound Name6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine
PubChem CID71335921
Molecular FormulaC13H30N2O
Molecular Weight230.40 g/mol
Exact Mass230.24
IUPAC Name6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine
SMILESCN(C)CCCCCCOCCCN(C)C
InChIInChI=1S/C13H30N2O/c1-14(2)10-7-5-6-8-12-16-13-9-11-15(3)4/h5-13H2,1-4H3
InChIKeyXZWHVGHSTRWWKX-UHFFFAOYSA-N
XLogP2.08
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine 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-[6-(dimethylamino)hexoxy]hexan-1-ol
CID 54275825
ethane;4-ethoxy-N,N-dimethylbutan-1-amine
CID 144519642
3-(2-aminoethoxy)-N,N-dimethylpropan-1-amine
CID 56993773
3-[4-[3-(dimethylamino)propoxy]butoxy]-N-methylpropan-1-amine
CID 58806980
1-[5-(dimethylamino)pentoxy]propan-2-one;ethane
CID 142389541
1-[5-(dimethylamino)pentoxy]propan-2-one
CID 118445875
potassium 2-[2-[3-(dimethylamino)propoxy]ethoxy]ethanolate
CID 159366457
N,N,N',N'-tetramethylpentane-1,5-diamine;dihydrobromide
CID 173097999
4-[3-(dimethylamino)propoxy]-N-propylbutan-1-amine
CID 62458821
N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine
CID 156656265
N,N,N',N'-tetramethylbutane-1,4-diamine;dihydrochloride
CID 20545505

Frequently Asked Questions

What is the IUPAC name of 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine?
The IUPAC name of 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine (CID 71335921) is 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine.
What is the SMILES notation for 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine?
The canonical SMILES for 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine is CN(C)CCCCCCOCCCN(C)C.
What is the InChIKey of 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine?
The InChIKey is XZWHVGHSTRWWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O/c1-14(2)10-7-5-6-8-12-16-13-9-11-15(3)4/h5-13H2,1-4H3.
What are the key properties of 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine?
6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine has a molecular weight of 230.40 g/mol, XLogP of 2.08, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine is sourced from PubChem (CID 71335921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).