1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol

C16H19FN2O — CID 61448699

IUPAC1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol
SMILESCCN(Cc1ccncc1)c1cccc(F)c1C(C)O
InChIInChI=1S/C16H19FN2O/c1-3-19(11-13-7-9-18-10-8-13)15-6-4-5-14(17)16(15)12(2)20/h4-10,12,20H,3,11H2,1-2H3
InChIKeyUGYMIFGKKSZXRO-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.30
Rot. Bonds5

About 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol

1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol (PubChem CID 61448699) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol.

Molecular Properties

Compound Name1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol
PubChem CID61448699
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC Name1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol
SMILESCCN(Cc1ccncc1)c1cccc(F)c1C(C)O
InChIInChI=1S/C16H19FN2O/c1-3-19(11-13-7-9-18-10-8-13)15-6-4-5-14(17)16(15)12(2)20/h4-10,12,20H,3,11H2,1-2H3
InChIKeyUGYMIFGKKSZXRO-UHFFFAOYSA-N
XLogP3.30
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-1-[2-fluoro-6-[methyl(2-pyridin-4-ylethyl)amino]phenyl]ethanol
CID 78939866
1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanone
CID 60678602
(1R)-1-[2-[ethyl(2-hydroxyethyl)amino]-6-fluorophenyl]ethanol
CID 63371083
(1S)-1-[2-[cyclopropylmethyl(ethyl)amino]-6-fluorophenyl]ethanol
CID 78954480
(1S)-1-[2-[ethyl(propan-2-yl)amino]-6-fluorophenyl]ethanol
CID 78939528
(1R)-1-[2-[ethyl(propan-2-yl)amino]-6-fluorophenyl]ethanol
CID 63370786
(1R)-1-[2-[cyclobutylmethyl(ethyl)amino]-6-fluorophenyl]ethanol
CID 107399695
1-[2-fluoro-6-[methyl(pyridin-3-ylmethyl)amino]phenyl]ethanol
CID 43563565
1-[2-[butan-2-yl(ethyl)amino]-6-fluorophenyl]ethanol
CID 43506187
1-[2-[bis(2-ethoxyethyl)amino]-6-fluorophenyl]ethanol
CID 82939297
2-N-ethyl-2-N-(pyridin-4-ylmethyl)benzene-1,2-diamine
CID 54948094
(1S)-1-[2-fluoro-6-[propyl(2,2,2-trifluoroethyl)amino]phenyl]ethanol
CID 55183941

Frequently Asked Questions

What is the IUPAC name of 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol?
The IUPAC name of 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol (CID 61448699) is 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol.
What is the SMILES notation for 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol?
The canonical SMILES for 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol is CCN(Cc1ccncc1)c1cccc(F)c1C(C)O.
What is the InChIKey of 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol?
The InChIKey is UGYMIFGKKSZXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-3-19(11-13-7-9-18-10-8-13)15-6-4-5-14(17)16(15)12(2)20/h4-10,12,20H,3,11H2,1-2H3.
What are the key properties of 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol?
1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol has a molecular weight of 274.34 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[ethyl(pyridin-4-ylmethyl)amino]-6-fluorophenyl]ethanol is sourced from PubChem (CID 61448699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).