4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol

C7H7ClF2N2O — CID 130072411

IUPAC4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol
SMILESNCc1cc(C(F)F)nc(Cl)c1O
InChIInChI=1S/C7H7ClF2N2O/c8-6-5(13)3(2-11)1-4(12-6)7(9)10/h1,7,13H,2,11H2
InChIKeyWCAIREBJMZAMOT-UHFFFAOYSA-N
MW208.59 g/mol
LogP1.84
Rot. Bonds2

About 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol

4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol (PubChem CID 130072411) has the molecular formula C7H7ClF2N2O and a molecular weight of 208.59 g/mol. Its IUPAC name is 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol.

Molecular Properties

Compound Name4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol
PubChem CID130072411
Molecular FormulaC7H7ClF2N2O
Molecular Weight208.59 g/mol
Exact Mass208.02
IUPAC Name4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol
SMILESNCc1cc(C(F)F)nc(Cl)c1O
InChIInChI=1S/C7H7ClF2N2O/c8-6-5(13)3(2-11)1-4(12-6)7(9)10/h1,7,13H,2,11H2
InChIKeyWCAIREBJMZAMOT-UHFFFAOYSA-N
XLogP1.84
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.59
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-4-(chloromethyl)-6-(difluoromethyl)pyridin-3-ol
CID 130072471
4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-amine
CID 130102646
2-[4-(aminomethyl)-6-(difluoromethyl)-3-hydroxy-2-pyridinyl]acetonitrile
CID 118807286
4-(aminomethyl)-3-chloro-6-(difluoromethyl)pyridine-2-carbaldehyde
CID 118829181
[3-chloro-6-(difluoromethyl)-2-methoxy-4-pyridinyl]methanamine
CID 130073730
4-(chloromethyl)-6-(difluoromethyl)-2-fluoropyridin-3-ol
CID 130079502
[6-(difluoromethyl)-3-iodo-2-methyl-4-pyridinyl]methanamine
CID 118852482
3-bromo-2-chloro-4-(chloromethyl)-6-(difluoromethyl)pyridine
CID 130108097
4-amino-2-(aminomethyl)-6-(difluoromethyl)pyridin-3-ol
CID 118818065
[2-bromo-6-(difluoromethyl)-3-iodo-4-pyridinyl]methanamine
CID 130068220
[6-(difluoromethyl)-3-fluoro-2-methyl-4-pyridinyl]methanamine
CID 118834888
4-(aminomethyl)-2-bromo-6-(difluoromethyl)pyridin-3-amine
CID 130101865

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol?
The IUPAC name of 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol (CID 130072411) is 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol.
What is the SMILES notation for 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol?
The canonical SMILES for 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol is NCc1cc(C(F)F)nc(Cl)c1O.
What is the InChIKey of 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol?
The InChIKey is WCAIREBJMZAMOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O/c8-6-5(13)3(2-11)1-4(12-6)7(9)10/h1,7,13H,2,11H2.
What are the key properties of 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol?
4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol has a molecular weight of 208.59 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-2-chloro-6-(difluoromethyl)pyridin-3-ol is sourced from PubChem (CID 130072411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).