N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine

C10H24N2O — CID 13126654

IUPACN-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine
SMILESCCCNCCOCCNCCC
InChIInChI=1S/C10H24N2O/c1-3-5-11-7-9-13-10-8-12-6-4-2/h11-12H,3-10H2,1-2H3
InChIKeyBSSWPBRTMYLHKV-UHFFFAOYSA-N
MW188.31 g/mol
LogP1.00
Rot. Bonds10

About N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine

N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine (PubChem CID 13126654) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine
PubChem CID13126654
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC NameN-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine
SMILESCCCNCCOCCNCCC
InChIInChI=1S/C10H24N2O/c1-3-5-11-7-9-13-10-8-12-6-4-2/h11-12H,3-10H2,1-2H3
InChIKeyBSSWPBRTMYLHKV-UHFFFAOYSA-N
XLogP1.00
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine?
The IUPAC name of N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine (CID 13126654) is N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine.
What is the SMILES notation for N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine?
The canonical SMILES for N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine is CCCNCCOCCNCCC.
What is the InChIKey of N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine?
The InChIKey is BSSWPBRTMYLHKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-3-5-11-7-9-13-10-8-12-6-4-2/h11-12H,3-10H2,1-2H3.
What are the key properties of N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine?
N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine has a molecular weight of 188.31 g/mol, XLogP of 1.00, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(propylamino)ethoxy]ethyl]propan-1-amine is sourced from PubChem (CID 13126654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).