3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine

C8H10F2N2O2 — CID 135201532

IUPAC3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine
SMILESCOCCOc1cc(F)c(N)nc1F
InChIInChI=1S/C8H10F2N2O2/c1-13-2-3-14-6-4-5(9)8(11)12-7(6)10/h4H,2-3H2,1H3,(H2,11,12)
InChIKeyROGONIHXRVRJPQ-UHFFFAOYSA-N
MW204.18 g/mol
LogP0.97
Rot. Bonds4

About 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine

3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine (PubChem CID 135201532) has the molecular formula C8H10F2N2O2 and a molecular weight of 204.18 g/mol. Its IUPAC name is 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine.

Molecular Properties

Compound Name3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine
PubChem CID135201532
Molecular FormulaC8H10F2N2O2
Molecular Weight204.18 g/mol
Exact Mass204.07
IUPAC Name3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine
SMILESCOCCOc1cc(F)c(N)nc1F
InChIInChI=1S/C8H10F2N2O2/c1-13-2-3-14-6-4-5(9)8(11)12-7(6)10/h4H,2-3H2,1H3,(H2,11,12)
InChIKeyROGONIHXRVRJPQ-UHFFFAOYSA-N
XLogP0.97
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.18
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine?
The IUPAC name of 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine (CID 135201532) is 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine.
What is the SMILES notation for 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine?
The canonical SMILES for 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine is COCCOc1cc(F)c(N)nc1F.
What is the InChIKey of 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine?
The InChIKey is ROGONIHXRVRJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O2/c1-13-2-3-14-6-4-5(9)8(11)12-7(6)10/h4H,2-3H2,1H3,(H2,11,12).
What are the key properties of 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine?
3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine has a molecular weight of 204.18 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-difluoro-5-(2-methoxyethoxy)pyridin-2-amine is sourced from PubChem (CID 135201532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).