2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol

C19H16F2N2O — CID 137306707

IUPAC2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol
SMILESCCNc1cc(-c2cccc(F)c2F)cc(-c2ccccc2O)n1
InChIInChI=1S/C19H16F2N2O/c1-2-22-18-11-12(13-7-5-8-15(20)19(13)21)10-16(23-18)14-6-3-4-9-17(14)24/h3-11,24H,2H2,1H3,(H,22,23)
InChIKeyADRLIHFZOKZFSZ-UHFFFAOYSA-N
MW326.35 g/mol
LogP4.83
Rot. Bonds4

About 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol

2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol (PubChem CID 137306707) has the molecular formula C19H16F2N2O and a molecular weight of 326.35 g/mol. Its IUPAC name is 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol.

Molecular Properties

Compound Name2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol
PubChem CID137306707
Molecular FormulaC19H16F2N2O
Molecular Weight326.35 g/mol
Exact Mass326.12
IUPAC Name2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol
SMILESCCNc1cc(-c2cccc(F)c2F)cc(-c2ccccc2O)n1
InChIInChI=1S/C19H16F2N2O/c1-2-22-18-11-12(13-7-5-8-15(20)19(13)21)10-16(23-18)14-6-3-4-9-17(14)24/h3-11,24H,2H2,1H3,(H,22,23)
InChIKeyADRLIHFZOKZFSZ-UHFFFAOYSA-N
XLogP4.83
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol?
The IUPAC name of 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol (CID 137306707) is 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol.
What is the SMILES notation for 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol?
The canonical SMILES for 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol is CCNc1cc(-c2cccc(F)c2F)cc(-c2ccccc2O)n1.
What is the InChIKey of 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol?
The InChIKey is ADRLIHFZOKZFSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O/c1-2-22-18-11-12(13-7-5-8-15(20)19(13)21)10-16(23-18)14-6-3-4-9-17(14)24/h3-11,24H,2H2,1H3,(H,22,23).
What are the key properties of 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol?
2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol has a molecular weight of 326.35 g/mol, XLogP of 4.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2,3-difluorophenyl)-6-(ethylamino)-2-pyridinyl]phenol is sourced from PubChem (CID 137306707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).