N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine

C10H24N2O2 — CID 143998493

IUPACN-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine
SMILESCCCNCCOC(C)(C)OCCN
InChIInChI=1S/C10H24N2O2/c1-4-6-12-7-9-14-10(2,3)13-8-5-11/h12H,4-9,11H2,1-3H3
InChIKeyXQIHZWJZRGAFSI-UHFFFAOYSA-N
MW204.31 g/mol
LogP0.71
Rot. Bonds9

About N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine

N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine (PubChem CID 143998493) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine
PubChem CID143998493
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC NameN-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine
SMILESCCCNCCOC(C)(C)OCCN
InChIInChI=1S/C10H24N2O2/c1-4-6-12-7-9-14-10(2,3)13-8-5-11/h12H,4-9,11H2,1-3H3
InChIKeyXQIHZWJZRGAFSI-UHFFFAOYSA-N
XLogP0.71
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-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

azane;N'-propylethane-1,2-diamine
CID 87476258
N-(2-ethoxyethyl)propan-1-amine;methane
CID 157152444
2-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethanamine
CID 156719251
2-(3-methylpentan-3-yloxy)ethanamine
CID 87222058
cyclopropane;N'-propylethane-1,2-diamine
CID 175530712
N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]-3-oxo-1λ3,2-iodoxirane-1-carboxamide
CID 88901046
5-methyl-5-[3-methyl-3-[2-(propylamino)ethoxy]butoxy]hexan-2-one
CID 172602784
2-[2-[2-(2-aminoethoxy)ethylamino]ethoxy]ethanamine
CID 15792937
N-[2-(2-methylbutan-2-yloxy)ethyl]pentan-1-amine
CID 62597960
2-(methylsulfonylmethoxy)-2-propoxypropane
CID 129117784
formaldehyde;N'-[2-(propylamino)ethyl]ethane-1,2-diamine
CID 174938120
2-[1,1-bis(2-aminoethoxy)butoxy]ethanamine
CID 151090377

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine?
The IUPAC name of N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine (CID 143998493) is N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine.
What is the SMILES notation for N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine?
The canonical SMILES for N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine is CCCNCCOC(C)(C)OCCN.
What is the InChIKey of N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine?
The InChIKey is XQIHZWJZRGAFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-4-6-12-7-9-14-10(2,3)13-8-5-11/h12H,4-9,11H2,1-3H3.
What are the key properties of N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine?
N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine has a molecular weight of 204.31 g/mol, XLogP of 0.71, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-aminoethoxy)propan-2-yloxy]ethyl]propan-1-amine is sourced from PubChem (CID 143998493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).