2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol

C20H21N3O — CID 66962752

IUPAC2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol
SMILESCCNC(c1ccccc1)C(O)(c1cccnc1)c1cccnc1
InChIInChI=1S/C20H21N3O/c1-2-23-19(16-8-4-3-5-9-16)20(24,17-10-6-12-21-14-17)18-11-7-13-22-15-18/h3-15,19,23-24H,2H2,1H3
InChIKeyLFRKQCJQYAHEQT-UHFFFAOYSA-N
MW319.41 g/mol
LogP3.06
Rot. Bonds6

About 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol

2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol (PubChem CID 66962752) has the molecular formula C20H21N3O and a molecular weight of 319.41 g/mol. Its IUPAC name is 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol.

Molecular Properties

Compound Name2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol
PubChem CID66962752
Molecular FormulaC20H21N3O
Molecular Weight319.41 g/mol
Exact Mass319.17
IUPAC Name2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol
SMILESCCNC(c1ccccc1)C(O)(c1cccnc1)c1cccnc1
InChIInChI=1S/C20H21N3O/c1-2-23-19(16-8-4-3-5-9-16)20(24,17-10-6-12-21-14-17)18-11-7-13-22-15-18/h3-15,19,23-24H,2H2,1H3
InChIKeyLFRKQCJQYAHEQT-UHFFFAOYSA-N
XLogP3.06
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2,2-trifluoro-N-[(1R)-2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl]acetamide
CID 87216450
N-[2-[[(1R)-2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl]amino]-2-oxoethyl]benzamide
CID 69101909
N-[(1R)-2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl]-2-phenylmethoxyacetamide
CID 57425636
N-(2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl)-3-methoxybenzamide
CID 77212044
2-methyl-2-phenyl-N-propyl-1-pyridin-3-ylpropan-1-amine
CID 63084520
trans-(1R,2R)-N-[(1R)-2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl]-2-phenylcyclopropane-1-carboxamide
CID 66962407
N-ethyl-2-methoxy-2-methyl-1-pyridin-3-ylpropan-1-amine
CID 79198385
tert-butyl N-[(2S)-1-[[(1R)-2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl]amino]-1-oxo-4-phenylbutan-2-yl]carbamate
CID 59706147
butyl N-[1-[(2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl)amino]-1-oxo-4-phenylbutan-2-yl]carbamate
CID 70796481
4-amino-3-hydroxy-N-(2-hydroxy-1-phenyl-2,2-dipyridin-3-ylethyl)-2-(2-phenylethyl)butanamide
CID 70796512
2-ethoxy-N-ethyl-2-methyl-1-pyridin-3-ylpropan-1-amine
CID 116726790
N-ethyl-2-methyl-2-methylsulfonyl-1-pyridin-3-ylpropan-1-amine
CID 115799186

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol?
The IUPAC name of 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol (CID 66962752) is 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol.
What is the SMILES notation for 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol?
The canonical SMILES for 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol is CCNC(c1ccccc1)C(O)(c1cccnc1)c1cccnc1.
What is the InChIKey of 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol?
The InChIKey is LFRKQCJQYAHEQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O/c1-2-23-19(16-8-4-3-5-9-16)20(24,17-10-6-12-21-14-17)18-11-7-13-22-15-18/h3-15,19,23-24H,2H2,1H3.
What are the key properties of 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol?
2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol has a molecular weight of 319.41 g/mol, XLogP of 3.06, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-phenyl-1,1-dipyridin-3-ylethanol is sourced from PubChem (CID 66962752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).