(1R)-1-aminoethane-1,2-diol

C2H7NO2 — CID 140649256

IUPAC(1R)-1-aminoethane-1,2-diol
SMILESN[C@H](O)CO
InChIInChI=1S/C2H7NO2/c3-2(5)1-4/h2,4-5H,1,3H2/t2-/m1/s1
InChIKeyGODZNYBQGNSJJN-UWTATZPHSA-N
MW77.08 g/mol
LogP-1.74
Rot. Bonds1

About (1R)-1-aminoethane-1,2-diol

(1R)-1-aminoethane-1,2-diol (PubChem CID 140649256) has the molecular formula C2H7NO2 and a molecular weight of 77.08 g/mol. Its IUPAC name is (1R)-1-aminoethane-1,2-diol.

Molecular Properties

Compound Name(1R)-1-aminoethane-1,2-diol
PubChem CID140649256
Molecular FormulaC2H7NO2
Molecular Weight77.08 g/mol
Exact Mass77.05
IUPAC Name(1R)-1-aminoethane-1,2-diol
SMILESN[C@H](O)CO
InChIInChI=1S/C2H7NO2/c3-2(5)1-4/h2,4-5H,1,3H2/t2-/m1/s1
InChIKeyGODZNYBQGNSJJN-UWTATZPHSA-N
XLogP-1.74
TPSA66.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50077.08
LogP ≤ 5-1.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-amino-2-silylethanol
CID 173493084
(2R,3R)-3-aminobutane-1,2-diol
CID 14325608
(2S,3S,5S,6S)-2,6-diaminoheptane-1,3,5,7-tetrol
CID 46884294
3-(2-amino-2-hydroxyethoxy)propane-1,2-diol
CID 87602858
1-amino-3-ethylbutane-1,4-diol
CID 22444229
disodium;1,2-diaminoethanol;hydride
CID 175201156
1-aminopropan-1-ol;hydrochloride
CID 18547293
2-aminopropan-1-ol;hydrofluoride
CID 22617394
(2S,3S,4R)-1-aminopentane-1,2,3,4,5-pentol
CID 139898597
1-amino-4-(2-hydroxyethyl)hexane-1,6-diol
CID 57138819
(2S,3R,4R)-4-aminopentane-1,2,3,5-tetrol
CID 126485687
1,3-diaminopropan-1-ol
CID 10419133

Frequently Asked Questions

What is the IUPAC name of (1R)-1-aminoethane-1,2-diol?
The IUPAC name of (1R)-1-aminoethane-1,2-diol (CID 140649256) is (1R)-1-aminoethane-1,2-diol.
What is the SMILES notation for (1R)-1-aminoethane-1,2-diol?
The canonical SMILES for (1R)-1-aminoethane-1,2-diol is N[C@H](O)CO.
What is the InChIKey of (1R)-1-aminoethane-1,2-diol?
The InChIKey is GODZNYBQGNSJJN-UWTATZPHSA-N. The full InChI is InChI=1S/C2H7NO2/c3-2(5)1-4/h2,4-5H,1,3H2/t2-/m1/s1.
What are the key properties of (1R)-1-aminoethane-1,2-diol?
(1R)-1-aminoethane-1,2-diol has a molecular weight of 77.08 g/mol, XLogP of -1.74, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-aminoethane-1,2-diol is sourced from PubChem (CID 140649256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).