2-[(1-ethylazetidin-3-yl)amino]ethanol

C7H16N2O — CID 126997572

IUPAC2-[(1-ethylazetidin-3-yl)amino]ethanol
SMILESCCN1CC(NCCO)C1
InChIInChI=1S/C7H16N2O/c1-2-9-5-7(6-9)8-3-4-10/h7-8,10H,2-6H2,1H3
InChIKeyYNJBWPSJLJWWDP-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.73
Rot. Bonds4

About 2-[(1-ethylazetidin-3-yl)amino]ethanol

2-[(1-ethylazetidin-3-yl)amino]ethanol (PubChem CID 126997572) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 2-[(1-ethylazetidin-3-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(1-ethylazetidin-3-yl)amino]ethanol
PubChem CID126997572
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name2-[(1-ethylazetidin-3-yl)amino]ethanol
SMILESCCN1CC(NCCO)C1
InChIInChI=1S/C7H16N2O/c1-2-9-5-7(6-9)8-3-4-10/h7-8,10H,2-6H2,1H3
InChIKeyYNJBWPSJLJWWDP-UHFFFAOYSA-N
XLogP-0.73
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-((2-Amino-1-methylethyl)amino)ethanol
CID 61487
2-(2-Methylpiperazin-1-yl)ethan-1-ol
CID 14747391
2-(2-Aminoethylamino)butan-1-ol
CID 469916
(2S)-2-[2-[[(1S)-1-(hydroxymethyl)propyl]-methyl-amino]ethylamino]butan-1-ol
CID 3000886
2-[(2R,6S)-2,6-dimethylpiperazin-1-yl]ethan-1-ol
CID 93500290
2-(2-Diethylaminoethylamino)butan-1-ol
CID 469919
2-[Ethyl-[2-(isopropylamino)ethyl]amino]butan-1-ol
CID 469924
2-(3-Methylpiperazin-1-yl)ethanol
CID 232250
2-[(Azetidin-3-yl)(methyl)amino]ethan-1-ol dihydrochloride
CID 165956009
2-{[(2S)-2-Aminopropyl](methyl)amino}ethan-1-ol
CID 45087524
2-[[(2~{S})-2-azanylpropyl]amino]ethanol
CID 137349072
2-[(2-Aminopropyl)amino]ethan-1-ol
CID 20159203

Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylazetidin-3-yl)amino]ethanol?
The IUPAC name of 2-[(1-ethylazetidin-3-yl)amino]ethanol (CID 126997572) is 2-[(1-ethylazetidin-3-yl)amino]ethanol.
What is the SMILES notation for 2-[(1-ethylazetidin-3-yl)amino]ethanol?
The canonical SMILES for 2-[(1-ethylazetidin-3-yl)amino]ethanol is CCN1CC(NCCO)C1.
What is the InChIKey of 2-[(1-ethylazetidin-3-yl)amino]ethanol?
The InChIKey is YNJBWPSJLJWWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-2-9-5-7(6-9)8-3-4-10/h7-8,10H,2-6H2,1H3.
What are the key properties of 2-[(1-ethylazetidin-3-yl)amino]ethanol?
2-[(1-ethylazetidin-3-yl)amino]ethanol has a molecular weight of 144.22 g/mol, XLogP of -0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylazetidin-3-yl)amino]ethanol is sourced from PubChem (CID 126997572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).