(2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol

C7H10IN3O — CID 130737806

IUPAC(2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol
SMILESNc1c(I)cncc1[C@@H](N)CO
InChIInChI=1S/C7H10IN3O/c8-5-2-11-1-4(7(5)10)6(9)3-12/h1-2,6,12H,3,9H2,(H2,10,11)/t6-/m0/s1
InChIKeyZJQUSFMMNROYIR-LURJTMIESA-N
MW279.08 g/mol
LogP0.26
Rot. Bonds2

About (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol

(2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol (PubChem CID 130737806) has the molecular formula C7H10IN3O and a molecular weight of 279.08 g/mol. Its IUPAC name is (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol.

Molecular Properties

Compound Name(2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol
PubChem CID130737806
Molecular FormulaC7H10IN3O
Molecular Weight279.08 g/mol
Exact Mass278.99
IUPAC Name(2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol
SMILESNc1c(I)cncc1[C@@H](N)CO
InChIInChI=1S/C7H10IN3O/c8-5-2-11-1-4(7(5)10)6(9)3-12/h1-2,6,12H,3,9H2,(H2,10,11)/t6-/m0/s1
InChIKeyZJQUSFMMNROYIR-LURJTMIESA-N
XLogP0.26
TPSA85.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.08
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

3-[(1S)-1-aminoprop-2-enyl]-5-iodopyridin-4-amine
CID 130691902
4-amino-5-iodopyridin-3-ol
CID 133055887
(2S)-2-amino-2-isoquinolin-4-ylethanol
CID 55262875
5-iodopyridine-3,4-diamine
CID 104509140
(2R)-2-amino-2-(4-chloro-3-pyridinyl)ethanol
CID 130738472
(2R)-2-amino-2-(4-methylpyrimidin-5-yl)ethanol
CID 96635522
(2S)-2-amino-2-(2-amino-5-iodophenyl)ethanol
CID 66515777
(2S)-2-amino-2-(2-iodo-5-methylphenyl)ethanol
CID 66515904
2-amino-2-(3,5-difluoro-4-pyridinyl)ethanol;dihydrochloride
CID 162344202
4-amino-5-iodopyridine-3-carboxylic acid
CID 71055662
(2R)-2-amino-2-(2-amino-5-chloro-3-pyridinyl)ethanol
CID 130710939
5-(1-amino-2-hydroxyethyl)-3-propan-2-ylpyrimidin-4-one
CID 83880057

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol?
The IUPAC name of (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol (CID 130737806) is (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol.
What is the SMILES notation for (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol?
The canonical SMILES for (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol is Nc1c(I)cncc1[C@@H](N)CO.
What is the InChIKey of (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol?
The InChIKey is ZJQUSFMMNROYIR-LURJTMIESA-N. The full InChI is InChI=1S/C7H10IN3O/c8-5-2-11-1-4(7(5)10)6(9)3-12/h1-2,6,12H,3,9H2,(H2,10,11)/t6-/m0/s1.
What are the key properties of (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol?
(2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol has a molecular weight of 279.08 g/mol, XLogP of 0.26, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(4-amino-5-iodo-3-pyridinyl)ethanol is sourced from PubChem (CID 130737806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).