N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine

C11H26N2O2 — CID 171539596

IUPACN-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine
SMILESCC(C)CNCCOCCOCCCN
InChIInChI=1S/C11H26N2O2/c1-11(2)10-13-5-7-15-9-8-14-6-3-4-12/h11,13H,3-10,12H2,1-2H3
InChIKeyUCZAXUDXUCNODS-UHFFFAOYSA-N
MW218.34 g/mol
LogP0.61
Rot. Bonds11

About N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine

N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine (PubChem CID 171539596) has the molecular formula C11H26N2O2 and a molecular weight of 218.34 g/mol. Its IUPAC name is N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine
PubChem CID171539596
Molecular FormulaC11H26N2O2
Molecular Weight218.34 g/mol
Exact Mass218.20
IUPAC NameN-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine
SMILESCC(C)CNCCOCCOCCCN
InChIInChI=1S/C11H26N2O2/c1-11(2)10-13-5-7-15-9-8-14-6-3-4-12/h11,13H,3-10,12H2,1-2H3
InChIKeyUCZAXUDXUCNODS-UHFFFAOYSA-N
XLogP0.61
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-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-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]propan-1-amine
CID 106449858
N-(2-heptoxyethyl)-2-methylpropan-1-amine
CID 62457906
2-methyl-N-[2-(4-methylpentoxy)ethyl]propan-1-amine;molecular hydrogen
CID 157169252
2-methyl-N-[2-[2-[2-(2-propan-2-yloxyethoxy)ethoxy]ethoxy]ethyl]propan-1-amine
CID 146640685
N-[3-[2-(2-methoxyethoxy)ethoxy]propyl]-2-methylpropan-1-amine
CID 104560835
2-methyl-N-[3-(2-propoxyethoxy)propyl]propan-1-amine
CID 63684721
(2S)-1-[2-[2-(2-methylpropylamino)ethoxy]ethylamino]propane-2-thiol
CID 167242879
4-(2-methoxyethoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456720
3-[2-(4-methylpentoxy)ethoxy]propan-1-amine
CID 155228800
N-(2-ethoxyethyl)-2-methylpropan-1-amine
CID 43387935
4-(4-methylpentoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456980
2-methyl-N-[3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]propyl]propan-1-amine
CID 112587455

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine?
The IUPAC name of N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine (CID 171539596) is N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine is CC(C)CNCCOCCOCCCN.
What is the InChIKey of N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine?
The InChIKey is UCZAXUDXUCNODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O2/c1-11(2)10-13-5-7-15-9-8-14-6-3-4-12/h11,13H,3-10,12H2,1-2H3.
What are the key properties of N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine?
N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine has a molecular weight of 218.34 g/mol, XLogP of 0.61, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(3-aminopropoxy)ethoxy]ethyl]-2-methylpropan-1-amine is sourced from PubChem (CID 171539596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).