1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol

C15H17FN2O — CID 83132069

IUPAC1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol
SMILESCCN(c1ccc(C(C)O)nc1)c1ccccc1F
InChIInChI=1S/C15H17FN2O/c1-3-18(15-7-5-4-6-13(15)16)12-8-9-14(11(2)19)17-10-12/h4-11,19H,3H2,1-2H3
InChIKeyBKFRVVSJXDXWAZ-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.43
Rot. Bonds4

About 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol

1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol (PubChem CID 83132069) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol
PubChem CID83132069
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol
SMILESCCN(c1ccc(C(C)O)nc1)c1ccccc1F
InChIInChI=1S/C15H17FN2O/c1-3-18(15-7-5-4-6-13(15)16)12-8-9-14(11(2)19)17-10-12/h4-11,19H,3H2,1-2H3
InChIKeyBKFRVVSJXDXWAZ-UHFFFAOYSA-N
XLogP3.43
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(N-ethyl-2-methylanilino)-2-pyridinyl]ethanol
CID 83132708
N-ethyl-2-fluoro-N-[4-[(propan-2-ylamino)methyl]phenyl]aniline
CID 63552892
(1R)-1-[5-[ethyl(pyridin-2-ylmethyl)amino]-2-pyridinyl]ethanol
CID 83132096
(1S)-1-[5-[butan-2-yl(ethyl)amino]-2-pyridinyl]ethanol
CID 83132626
1-[5-(3-fluoro-N-methylanilino)-2-pyridinyl]ethanol
CID 83131802
(1S)-1-[2-(N-ethyl-4-fluoroanilino)phenyl]ethanol
CID 78940914
6-[(1R)-1-aminoethyl]-N-ethyl-N-phenylpyridin-3-amine
CID 83122129
(1R)-1-[5-[ethyl(2-methylbutyl)amino]-2-pyridinyl]ethanol
CID 83132263
1-[5-[1-(dimethylamino)propan-2-yl-ethylamino]-2-pyridinyl]ethanol
CID 103189789
6-(1-aminopropyl)-N-ethyl-N-phenylpyridin-3-amine
CID 112584084
3-(N-ethyl-2-fluoroanilino)-1-(5-fluoro-2-pyridinyl)propan-1-ol
CID 83111121
N-ethyl-6-[1-(methylamino)propyl]-N-(2-methylphenyl)pyridin-3-amine
CID 115939182

Frequently Asked Questions

What is the IUPAC name of 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol?
The IUPAC name of 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol (CID 83132069) is 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol.
What is the SMILES notation for 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol?
The canonical SMILES for 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol is CCN(c1ccc(C(C)O)nc1)c1ccccc1F.
What is the InChIKey of 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol?
The InChIKey is BKFRVVSJXDXWAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c1-3-18(15-7-5-4-6-13(15)16)12-8-9-14(11(2)19)17-10-12/h4-11,19H,3H2,1-2H3.
What are the key properties of 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol?
1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol has a molecular weight of 260.31 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(N-ethyl-2-fluoroanilino)-2-pyridinyl]ethanol is sourced from PubChem (CID 83132069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).