6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol

C7H7F2IN2O — CID 118848322

IUPAC6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol
SMILESNCc1nc(C(F)F)c(O)cc1I
InChIInChI=1S/C7H7F2IN2O/c8-7(9)6-5(13)1-3(10)4(2-11)12-6/h1,7,13H,2,11H2
InChIKeyMSTFZAUIIVFGNK-UHFFFAOYSA-N
MW300.05 g/mol
LogP1.79
Rot. Bonds2

About 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol

6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol (PubChem CID 118848322) has the molecular formula C7H7F2IN2O and a molecular weight of 300.05 g/mol. Its IUPAC name is 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol.

Molecular Properties

Compound Name6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol
PubChem CID118848322
Molecular FormulaC7H7F2IN2O
Molecular Weight300.05 g/mol
Exact Mass299.96
IUPAC Name6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol
SMILESNCc1nc(C(F)F)c(O)cc1I
InChIInChI=1S/C7H7F2IN2O/c8-7(9)6-5(13)1-3(10)4(2-11)12-6/h1,7,13H,2,11H2
InChIKeyMSTFZAUIIVFGNK-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': 'iodine', 'substructure': 'N/A'}

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Related Compounds

[6-(aminomethyl)-2-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118820073
2-[6-(difluoromethyl)-5-hydroxy-3-iodo-2-pyridinyl]acetic acid
CID 118820391
[5-chloro-6-(difluoromethyl)-3-iodo-2-pyridinyl]methanamine
CID 118814520
6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridine-3-carbonitrile
CID 118814384
ethyl 2-[2-(aminomethyl)-6-(difluoromethyl)-5-hydroxy-3-pyridinyl]acetate
CID 133102537
6-(aminomethyl)-2-(difluoromethyl)-5-(trifluoromethoxy)pyridin-3-ol
CID 118842664
2-[3-amino-6-(difluoromethyl)-5-hydroxy-2-pyridinyl]acetic acid
CID 133093449
2-(aminomethyl)-6-(difluoromethyl)-5-iodopyridine-3-carbonitrile
CID 118831357
2-[6-(aminomethyl)-2-(difluoromethyl)-5-fluoro-3-pyridinyl]acetic acid
CID 118853815
2-(aminomethyl)-4-(difluoromethyl)-6-iodopyridin-3-ol
CID 118808608
ethyl 2-[6-(difluoromethyl)-5-hydroxy-3-methyl-2-pyridinyl]acetate
CID 133102888
5-(aminomethyl)-6-(difluoromethyl)-4-iodopyridine-2-carboxylic acid
CID 130086964

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol?
The IUPAC name of 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol (CID 118848322) is 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol.
What is the SMILES notation for 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol?
The canonical SMILES for 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol is NCc1nc(C(F)F)c(O)cc1I.
What is the InChIKey of 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol?
The InChIKey is MSTFZAUIIVFGNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2IN2O/c8-7(9)6-5(13)1-3(10)4(2-11)12-6/h1,7,13H,2,11H2.
What are the key properties of 6-(aminomethyl)-2-(difluoromethyl)-5-iodopyridin-3-ol?
6-(aminomethyl)-2-(difluoromethyl)-5-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)-2-(difluoromethyl)-5-iodopyridin-3-ol is sourced from PubChem (CID 118848322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).