2-[ethyl-[3-(propylamino)propyl]amino]ethanol

C10H24N2O — CID 61387164

IUPAC2-[ethyl-[3-(propylamino)propyl]amino]ethanol
SMILESCCCNCCCN(CC)CCO
InChIInChI=1S/C10H24N2O/c1-3-6-11-7-5-8-12(4-2)9-10-13/h11,13H,3-10H2,1-2H3
InChIKeyBMZHHCXKIVSYDL-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.69
Rot. Bonds9

About 2-[ethyl-[3-(propylamino)propyl]amino]ethanol

2-[ethyl-[3-(propylamino)propyl]amino]ethanol (PubChem CID 61387164) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is 2-[ethyl-[3-(propylamino)propyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[3-(propylamino)propyl]amino]ethanol
PubChem CID61387164
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Name2-[ethyl-[3-(propylamino)propyl]amino]ethanol
SMILESCCCNCCCN(CC)CCO
InChIInChI=1S/C10H24N2O/c1-3-6-11-7-5-8-12(4-2)9-10-13/h11,13H,3-10H2,1-2H3
InChIKeyBMZHHCXKIVSYDL-UHFFFAOYSA-N
XLogP0.69
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.69
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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Related Compounds

2-[propyl-[3-(propylamino)propyl]amino]ethanol
CID 61424800
N'-butyl-N'-ethyl-N-propylpropane-1,3-diamine
CID 61386892
2-[3-(2-aminoethylamino)propyl-ethylamino]ethanol
CID 143093735
2-[ethyl(2-hydroxyethyl)amino]ethanol;2-(2-hydroxyethylamino)ethanol
CID 159800308
N'-ethyl-N'-[3-(propylamino)propyl]propane-1,3-diamine
CID 20833349
N'-butyl-N'-ethyl-N-propylethane-1,2-diamine
CID 61386883
2-[3-[3-[bis(2-hydroxyethyl)amino]propylamino]propyl-(2-hydroxyethyl)amino]ethanol;trihydrofluoride
CID 173445075
2-[2-hydroxyethyl(propyl)amino]ethanol;3-(3-hydroxypropylamino)propan-1-ol
CID 87517787
2-[ethyl(nonyl)amino]ethanol
CID 62021397
2-[ethyl(2-hydroxyethyl)amino]ethanol;2-[ethyl(propyl)amino]ethanol
CID 161297591
2-[ethyl-[3-(hydroxymethylamino)propyl]amino]ethanol;3-methylpentan-2-amine
CID 165397482
3-[2-(dodecylamino)ethyl-(2-hydroxyethyl)amino]propan-1-ol
CID 134519108

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[3-(propylamino)propyl]amino]ethanol?
The IUPAC name of 2-[ethyl-[3-(propylamino)propyl]amino]ethanol (CID 61387164) is 2-[ethyl-[3-(propylamino)propyl]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[3-(propylamino)propyl]amino]ethanol?
The canonical SMILES for 2-[ethyl-[3-(propylamino)propyl]amino]ethanol is CCCNCCCN(CC)CCO.
What is the InChIKey of 2-[ethyl-[3-(propylamino)propyl]amino]ethanol?
The InChIKey is BMZHHCXKIVSYDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O/c1-3-6-11-7-5-8-12(4-2)9-10-13/h11,13H,3-10H2,1-2H3.
What are the key properties of 2-[ethyl-[3-(propylamino)propyl]amino]ethanol?
2-[ethyl-[3-(propylamino)propyl]amino]ethanol has a molecular weight of 188.31 g/mol, XLogP of 0.69, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[3-(propylamino)propyl]amino]ethanol is sourced from PubChem (CID 61387164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).