2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine

C13H28N2O — CID 106707845

IUPAC2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine
SMILESCC1CN(CCCCC(C)(C)CN)CCO1
InChIInChI=1S/C13H28N2O/c1-12-10-15(8-9-16-12)7-5-4-6-13(2,3)11-14/h12H,4-11,14H2,1-3H3
InChIKeyCLYMMSFQGJOTBT-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.86
Rot. Bonds6

About 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine

2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine (PubChem CID 106707845) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine
PubChem CID106707845
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine
SMILESCC1CN(CCCCC(C)(C)CN)CCO1
InChIInChI=1S/C13H28N2O/c1-12-10-15(8-9-16-12)7-5-4-6-13(2,3)11-14/h12H,4-11,14H2,1-3H3
InChIKeyCLYMMSFQGJOTBT-UHFFFAOYSA-N
XLogP1.86
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-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

2-methyl-4-(2-methylmorpholin-4-yl)butan-2-amine
CID 64678329
1-(6-amino-5,5-dimethylhexyl)-3-methylpiperidin-4-ol
CID 106708252
N'-hydroxy-2,2-dimethyl-5-(2-methylmorpholin-4-yl)pentanimidamide
CID 77063063
azane;4-dodecyl-2-methylmorpholine;hydrobromide
CID 174921468
2,2-dimethyl-5-(2-methylmorpholin-4-yl)pentanimidamide
CID 65258854
1-amino-2-methyl-3-(2-methylmorpholin-4-yl)propan-2-ol
CID 64818772
2,2-dimethyl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)hexan-1-amine
CID 106708095
2-amino-2-ethyl-5-(2-methylmorpholin-4-yl)pentan-1-ol
CID 106809098
3-(2-methyl-1,4-oxazepan-4-yl)propan-1-amine
CID 62987056
acetic acid;4-butyl-2-methylmorpholine
CID 175198746
2,2-dimethyl-5-(2,2,6-trimethylmorpholin-4-yl)pentan-1-amine
CID 65254263
2,2-dimethyl-6-(4-methylazepan-1-yl)hexan-1-amine
CID 106708126

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine?
The IUPAC name of 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine (CID 106707845) is 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine.
What is the SMILES notation for 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine?
The canonical SMILES for 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine is CC1CN(CCCCC(C)(C)CN)CCO1.
What is the InChIKey of 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine?
The InChIKey is CLYMMSFQGJOTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-12-10-15(8-9-16-12)7-5-4-6-13(2,3)11-14/h12H,4-11,14H2,1-3H3.
What are the key properties of 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine?
2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine has a molecular weight of 228.38 g/mol, XLogP of 1.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-(2-methylmorpholin-4-yl)hexan-1-amine is sourced from PubChem (CID 106707845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).