6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol

C7H7F2IN2O — CID 130082575

IUPAC6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol
SMILESNCc1cc(C(F)F)c(O)c(I)n1
InChIInChI=1S/C7H7F2IN2O/c8-6(9)4-1-3(2-11)12-7(10)5(4)13/h1,6,13H,2,11H2
InChIKeyNDZLNSOBXWUMJZ-UHFFFAOYSA-N
MW300.05 g/mol
LogP1.79
Rot. Bonds2

About 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol

6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol (PubChem CID 130082575) has the molecular formula C7H7F2IN2O and a molecular weight of 300.05 g/mol. Its IUPAC name is 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol.

Molecular Properties

Compound Name6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol
PubChem CID130082575
Molecular FormulaC7H7F2IN2O
Molecular Weight300.05 g/mol
Exact Mass299.96
IUPAC Name6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol
SMILESNCc1cc(C(F)F)c(O)c(I)n1
InChIInChI=1S/C7H7F2IN2O/c8-6(9)4-1-3(2-11)12-7(10)5(4)13/h1,6,13H,2,11H2
InChIKeyNDZLNSOBXWUMJZ-UHFFFAOYSA-N
XLogP1.79
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 ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(aminomethyl)-4-(difluoromethyl)-6-iodopyridin-3-ol
CID 118808608
6-(aminomethyl)-4-(difluoromethyl)-3-hydroxypyridine-2-carbonitrile
CID 130076567
4-(difluoromethyl)-5-hydroxy-6-iodopyridine-2-carboxamide
CID 118840847
4-(difluoromethyl)-2-iodo-6-methoxypyridin-3-ol
CID 118852158
methyl 2-[6-(aminomethyl)-4-(difluoromethyl)-3-hydroxy-2-pyridinyl]acetate
CID 133102439
4-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridin-3-ol
CID 118823942
[5-(difluoromethyl)-6-iodo-4-methyl-2-pyridinyl]methanamine
CID 130085953
[5,6-dibromo-4-(difluoromethyl)-2-pyridinyl]methanamine
CID 130098957
[6-(aminomethyl)-4-(difluoromethyl)-5-iodo-2-pyridinyl]methanol
CID 130086878
[6-(aminomethyl)-3-chloro-4-(difluoromethyl)-2-pyridinyl]methanol
CID 130074984
[5-chloro-4-(difluoromethyl)-6-fluoro-2-pyridinyl]methanamine
CID 130071688
4-(difluoromethyl)-6-(hydroxymethyl)-2-methylpyridin-3-ol
CID 118834562

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol?
The IUPAC name of 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol (CID 130082575) is 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol.
What is the SMILES notation for 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol?
The canonical SMILES for 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol is NCc1cc(C(F)F)c(O)c(I)n1.
What is the InChIKey of 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol?
The InChIKey is NDZLNSOBXWUMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2IN2O/c8-6(9)4-1-3(2-11)12-7(10)5(4)13/h1,6,13H,2,11H2.
What are the key properties of 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol?
6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol has a molecular weight of 300.05 g/mol, XLogP of 1.79, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-4-(difluoromethyl)-2-iodopyridin-3-ol is sourced from PubChem (CID 130082575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).