N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine

C17H38N2O3 — CID 129102277

IUPACN-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCCOCCCOCCOCCNC(C)(C)C
InChIInChI=1S/C17H38N2O3/c1-16(2,3)18-8-12-20-10-7-11-21-14-15-22-13-9-19-17(4,5)6/h18-19H,7-15H2,1-6H3
InChIKeyJUTHESHYKHULOL-UHFFFAOYSA-N
MW318.50 g/mol
LogP2.20
Rot. Bonds13

About N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine

N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine (PubChem CID 129102277) has the molecular formula C17H38N2O3 and a molecular weight of 318.50 g/mol. Its IUPAC name is N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine
PubChem CID129102277
Molecular FormulaC17H38N2O3
Molecular Weight318.50 g/mol
Exact Mass318.29
IUPAC NameN-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCCOCCCOCCOCCNC(C)(C)C
InChIInChI=1S/C17H38N2O3/c1-16(2,3)18-8-12-20-10-7-11-21-14-15-22-13-9-19-17(4,5)6/h18-19H,7-15H2,1-6H3
InChIKeyJUTHESHYKHULOL-UHFFFAOYSA-N
XLogP2.20
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.50
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-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-[3-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]propoxy]ethoxy]ethyl]propan-2-amine
CID 126654287
N-(2-butoxyethyl)-2-methylpropan-2-amine
CID 61483179
N-[2-[2-[4-[2-(4,4-dimethylpentoxy)ethoxy]butoxy]ethoxy]ethyl]-2-methylpropan-2-amine
CID 169300394
2-methyl-N-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 138466955
N-[3-[3-(2-methoxyethoxy)propoxy]propyl]-2-methylpropan-2-amine
CID 103401793
N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]-2-methylpropan-2-amine
CID 58904017
N-tert-butyl-4-[3-(2-methoxyethoxy)propoxy]butan-1-amine
CID 103406524
2-methyl-N-[2-[5-(2-propan-2-yloxyethoxy)pentoxy]ethyl]propan-2-amine
CID 146520233
N-[3-[2-(2-butoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine
CID 89274543
N-[3-[2-(2-ethoxyethoxy)ethoxy]propyl]-2-methylpropan-2-amine
CID 89274546
N-[3-(2-methoxyethoxy)propyl]-2-methylpropan-2-amine
CID 62455424
N-[3-(3-ethoxypropoxy)propyl]-2-methylpropan-2-amine
CID 155219490

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine (CID 129102277) is N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine is CC(C)(C)NCCOCCCOCCOCCNC(C)(C)C.
What is the InChIKey of N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine?
The InChIKey is JUTHESHYKHULOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38N2O3/c1-16(2,3)18-8-12-20-10-7-11-21-14-15-22-13-9-19-17(4,5)6/h18-19H,7-15H2,1-6H3.
What are the key properties of N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine?
N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine has a molecular weight of 318.50 g/mol, XLogP of 2.20, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-[2-[2-(tert-butylamino)ethoxy]ethoxy]propoxy]ethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 129102277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).