4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol

C19H17FN2O — CID 126469684

IUPAC4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol
SMILESCC(Nc1ccc(-c2ccc(O)cc2)cn1)c1ccc(F)cc1
InChIInChI=1S/C19H17FN2O/c1-13(14-2-7-17(20)8-3-14)22-19-11-6-16(12-21-19)15-4-9-18(23)10-5-15/h2-13,23H,1H3,(H,21,22)
InChIKeyMEZDMFMSFAEWBP-UHFFFAOYSA-N
MW308.36 g/mol
LogP4.77
Rot. Bonds4

About 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol

4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol (PubChem CID 126469684) has the molecular formula C19H17FN2O and a molecular weight of 308.36 g/mol. Its IUPAC name is 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol.

Molecular Properties

Compound Name4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol
PubChem CID126469684
Molecular FormulaC19H17FN2O
Molecular Weight308.36 g/mol
Exact Mass308.13
IUPAC Name4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol
SMILESCC(Nc1ccc(-c2ccc(O)cc2)cn1)c1ccc(F)cc1
InChIInChI=1S/C19H17FN2O/c1-13(14-2-7-17(20)8-3-14)22-19-11-6-16(12-21-19)15-4-9-18(23)10-5-15/h2-13,23H,1H3,(H,21,22)
InChIKeyMEZDMFMSFAEWBP-UHFFFAOYSA-N
XLogP4.77
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 54.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol?
The IUPAC name of 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol (CID 126469684) is 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol.
What is the SMILES notation for 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol?
The canonical SMILES for 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol is CC(Nc1ccc(-c2ccc(O)cc2)cn1)c1ccc(F)cc1.
What is the InChIKey of 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol?
The InChIKey is MEZDMFMSFAEWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O/c1-13(14-2-7-17(20)8-3-14)22-19-11-6-16(12-21-19)15-4-9-18(23)10-5-15/h2-13,23H,1H3,(H,21,22).
What are the key properties of 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol?
4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol has a molecular weight of 308.36 g/mol, XLogP of 4.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[1-(4-fluorophenyl)ethylamino]-3-pyridinyl]phenol is sourced from PubChem (CID 126469684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).