2-[(2R)-2-aminopropoxy]ethanol

C5H13NO2 — CID 21097963

IUPAC2-[(2R)-2-aminopropoxy]ethanol
SMILESC[C@@H](N)COCCO
InChIInChI=1S/C5H13NO2/c1-5(6)4-8-3-2-7/h5,7H,2-4,6H2,1H3/t5-/m1/s1
InChIKeyPPMDUWWPENXLAV-RXMQYKEDSA-N
MW119.16 g/mol
LogP-0.66
Rot. Bonds4

About 2-[(2R)-2-aminopropoxy]ethanol

2-[(2R)-2-aminopropoxy]ethanol (PubChem CID 21097963) has the molecular formula C5H13NO2 and a molecular weight of 119.16 g/mol. Its IUPAC name is 2-[(2R)-2-aminopropoxy]ethanol.

Molecular Properties

Compound Name2-[(2R)-2-aminopropoxy]ethanol
PubChem CID21097963
Molecular FormulaC5H13NO2
Molecular Weight119.16 g/mol
Exact Mass119.09
IUPAC Name2-[(2R)-2-aminopropoxy]ethanol
SMILESC[C@@H](N)COCCO
InChIInChI=1S/C5H13NO2/c1-5(6)4-8-3-2-7/h5,7H,2-4,6H2,1H3/t5-/m1/s1
InChIKeyPPMDUWWPENXLAV-RXMQYKEDSA-N
XLogP-0.66
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.16
LogP ≤ 5-0.66
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-(2-aminopropoxy)ethanol;2-methylbut-2-ene
CID 174594441
4-amino-1-(2-hydroxyethoxy)pentan-2-ol
CID 158045647
2-[3-[3-(2-hydroxyethoxy)-2-methylpropoxy]-2-methylpropoxy]ethanol
CID 18784446
1-(2-hydroxyethoxy)propan-2-ol
CID 19360868
(2S)-1-[2-(2-methylpropoxy)ethoxy]propan-2-amine
CID 106447202
1-amino-2-(2-hydroxyethoxy)ethanol;hydrofluoride
CID 173050700
2-[2-[2-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 6428225
1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
CID 86587580
1-[2-(1-aminoethoxy)ethoxy]propan-2-amine
CID 153419048
(2S)-1-[2-(2-methoxyethoxy)ethoxy]propan-2-amine
CID 104560725
2-(2-hydroxyethoxy)ethanol;1-[2-(2-hydroxyethoxy)ethoxy]propan-2-ol
CID 161004910
2-[2-[2-[2-[2-(2-amino-2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 90384666

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-aminopropoxy]ethanol?
The IUPAC name of 2-[(2R)-2-aminopropoxy]ethanol (CID 21097963) is 2-[(2R)-2-aminopropoxy]ethanol.
What is the SMILES notation for 2-[(2R)-2-aminopropoxy]ethanol?
The canonical SMILES for 2-[(2R)-2-aminopropoxy]ethanol is C[C@@H](N)COCCO.
What is the InChIKey of 2-[(2R)-2-aminopropoxy]ethanol?
The InChIKey is PPMDUWWPENXLAV-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H13NO2/c1-5(6)4-8-3-2-7/h5,7H,2-4,6H2,1H3/t5-/m1/s1.
What are the key properties of 2-[(2R)-2-aminopropoxy]ethanol?
2-[(2R)-2-aminopropoxy]ethanol has a molecular weight of 119.16 g/mol, XLogP of -0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-aminopropoxy]ethanol is sourced from PubChem (CID 21097963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).