[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol

C7H7F2IN2O — CID 118993177

IUPAC[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
SMILESNc1nc(C(F)F)c(I)cc1CO
InChIInChI=1S/C7H7F2IN2O/c8-6(9)5-4(10)1-3(2-13)7(11)12-5/h1,6,13H,2H2,(H2,11,12)
InChIKeyQHZZLGWLENLYGH-UHFFFAOYSA-N
MW300.05 g/mol
LogP1.70
Rot. Bonds2

About [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol

[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol (PubChem CID 118993177) has the molecular formula C7H7F2IN2O and a molecular weight of 300.05 g/mol. Its IUPAC name is [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
PubChem CID118993177
Molecular FormulaC7H7F2IN2O
Molecular Weight300.05 g/mol
Exact Mass299.96
IUPAC Name[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
SMILESNc1nc(C(F)F)c(I)cc1CO
InChIInChI=1S/C7H7F2IN2O/c8-6(9)5-4(10)1-3(2-13)7(11)12-5/h1,6,13H,2H2,(H2,11,12)
InChIKeyQHZZLGWLENLYGH-UHFFFAOYSA-N
XLogP1.70
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.05
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(aminomethyl)-6-(difluoromethyl)-5-iodopyridin-2-amine
CID 119017545
[2-chloro-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118990772
[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol
CID 118854432
[6-(aminomethyl)-2-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118820073
[2,6-diamino-5-(difluoromethyl)-3-pyridinyl]methanol
CID 119025183
[6-amino-2-(difluoromethyl)-4-iodo-3-pyridinyl]methanol
CID 130105451
6-(difluoromethyl)-2,5-diiodopyridin-3-amine
CID 130100401
[2-(difluoromethyl)-5-iodo-6-methoxy-3-pyridinyl]methanol
CID 118848642
[4-amino-2-(difluoromethyl)-6-iodo-3-pyridinyl]methanol
CID 118850928
[2-(difluoromethyl)-5-iodo-6-nitro-3-pyridinyl]methanol
CID 118814976
2-[2-bromo-6-(difluoromethyl)-5-iodo-3-pyridinyl]acetic acid
CID 118998027
[6-(difluoromethyl)-5-iodo-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118826147

Frequently Asked Questions

What is the IUPAC name of [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol?
The IUPAC name of [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol (CID 118993177) is [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol.
What is the SMILES notation for [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol?
The canonical SMILES for [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol is Nc1nc(C(F)F)c(I)cc1CO.
What is the InChIKey of [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol?
The InChIKey is QHZZLGWLENLYGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2IN2O/c8-6(9)5-4(10)1-3(2-13)7(11)12-5/h1,6,13H,2H2,(H2,11,12).
What are the key properties of [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol?
[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol has a molecular weight of 300.05 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol is sourced from PubChem (CID 118993177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).