3-fluoro-2-iodo-2H-pyridin-1-amine

C5H6FIN2 — CID 176884326

IUPAC3-fluoro-2-iodo-2H-pyridin-1-amine
SMILESNN1C=CC=C(F)C1I
InChIInChI=1S/C5H6FIN2/c6-4-2-1-3-9(8)5(4)7/h1-3,5H,8H2
InChIKeySKWWDBVMECFJNL-UHFFFAOYSA-N
MW240.02 g/mol
LogP1.30
Rot. Bonds

About 3-fluoro-2-iodo-2H-pyridin-1-amine

3-fluoro-2-iodo-2H-pyridin-1-amine (PubChem CID 176884326) has the molecular formula C5H6FIN2 and a molecular weight of 240.02 g/mol. Its IUPAC name is 3-fluoro-2-iodo-2H-pyridin-1-amine.

Molecular Properties

Compound Name3-fluoro-2-iodo-2H-pyridin-1-amine
PubChem CID176884326
Molecular FormulaC5H6FIN2
Molecular Weight240.02 g/mol
Exact Mass239.96
IUPAC Name3-fluoro-2-iodo-2H-pyridin-1-amine
SMILESNN1C=CC=C(F)C1I
InChIInChI=1S/C5H6FIN2/c6-4-2-1-3-9(8)5(4)7/h1-3,5H,8H2
InChIKeySKWWDBVMECFJNL-UHFFFAOYSA-N
XLogP1.30
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.02
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

3-fluoro-1-prop-1-enyl-2H-pyridin-2-amine
CID 141446633
(3aR)-4-fluoro-3aH-indazol-3-amine
CID 86306343
(6S)-1,4,5,6-tetrafluorocyclohexa-1,3-diene
CID 155000957
2,6-difluorocyclohexa-2,4-dien-1-ol
CID 173042954
3-iodo-1-methyl-2H-pyridine
CID 121391421
1-amino-2H-pyridin-3-ol
CID 19886939
1,5-diiodo-6-methylcyclohexa-1,3-diene
CID 155148559
3-bromo-1,2-dimethyl-2H-pyridine
CID 123775346
1-methyl-2-methylidenepyridin-3-amine
CID 145084072
1-methyl-3,8a-dihydro-2H-tetrazolo[1,5-a]pyridin-8-ol
CID 19350370
6-amino-5-fluoro-1-methylcyclohexa-2,4-diene-1-carbonitrile
CID 146424265
(6S)-2,5-difluoro-7-methylbicyclo[4.1.1]octa-2,4-diene
CID 89121593

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-iodo-2H-pyridin-1-amine?
The IUPAC name of 3-fluoro-2-iodo-2H-pyridin-1-amine (CID 176884326) is 3-fluoro-2-iodo-2H-pyridin-1-amine.
What is the SMILES notation for 3-fluoro-2-iodo-2H-pyridin-1-amine?
The canonical SMILES for 3-fluoro-2-iodo-2H-pyridin-1-amine is NN1C=CC=C(F)C1I.
What is the InChIKey of 3-fluoro-2-iodo-2H-pyridin-1-amine?
The InChIKey is SKWWDBVMECFJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FIN2/c6-4-2-1-3-9(8)5(4)7/h1-3,5H,8H2.
What are the key properties of 3-fluoro-2-iodo-2H-pyridin-1-amine?
3-fluoro-2-iodo-2H-pyridin-1-amine has a molecular weight of 240.02 g/mol, XLogP of 1.30, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-iodo-2H-pyridin-1-amine is sourced from PubChem (CID 176884326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).