2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine

C14H15F2N3O2 — CID 43261797

IUPAC2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine
SMILESCCOc1nc(Nc2ccccc2OC(F)F)ccc1N
InChIInChI=1S/C14H15F2N3O2/c1-2-20-13-9(17)7-8-12(19-13)18-10-5-3-4-6-11(10)21-14(15)16/h3-8,14H,2,17H2,1H3,(H,18,19)
InChIKeyUWIDCRJPDYGMOG-UHFFFAOYSA-N
MW295.29 g/mol
LogP3.41
Rot. Bonds6

About 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine

2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine (PubChem CID 43261797) has the molecular formula C14H15F2N3O2 and a molecular weight of 295.29 g/mol. Its IUPAC name is 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine
PubChem CID43261797
Molecular FormulaC14H15F2N3O2
Molecular Weight295.29 g/mol
Exact Mass295.11
IUPAC Name2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine
SMILESCCOc1nc(Nc2ccccc2OC(F)F)ccc1N
InChIInChI=1S/C14H15F2N3O2/c1-2-20-13-9(17)7-8-12(19-13)18-10-5-3-4-6-11(10)21-14(15)16/h3-8,14H,2,17H2,1H3,(H,18,19)
InChIKeyUWIDCRJPDYGMOG-UHFFFAOYSA-N
XLogP3.41
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine?
The IUPAC name of 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine (CID 43261797) is 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine?
The canonical SMILES for 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine is CCOc1nc(Nc2ccccc2OC(F)F)ccc1N.
What is the InChIKey of 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine?
The InChIKey is UWIDCRJPDYGMOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F2N3O2/c1-2-20-13-9(17)7-8-12(19-13)18-10-5-3-4-6-11(10)21-14(15)16/h3-8,14H,2,17H2,1H3,(H,18,19).
What are the key properties of 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine?
2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine has a molecular weight of 295.29 g/mol, XLogP of 3.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[2-(difluoromethoxy)phenyl]-6-ethoxypyridine-2,5-diamine is sourced from PubChem (CID 43261797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).