(1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol

C19H19N3O — CID 99852293

IUPAC(1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol
SMILESO[C@@H](CN[C@H](c1ccccc1)c1ccncc1)c1ccncc1
InChIInChI=1S/C19H19N3O/c23-18(15-6-10-20-11-7-15)14-22-19(16-4-2-1-3-5-16)17-8-12-21-13-9-17/h1-13,18-19,22-23H,14H2/t18-,19+/m0/s1
InChIKeyHOPGALFQMUCJKN-RBUKOAKNSA-N
MW305.38 g/mol
LogP2.89
Rot. Bonds6

About (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol

(1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol (PubChem CID 99852293) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol.

Molecular Properties

Compound Name(1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol
PubChem CID99852293
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name(1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol
SMILESO[C@@H](CN[C@H](c1ccccc1)c1ccncc1)c1ccncc1
InChIInChI=1S/C19H19N3O/c23-18(15-6-10-20-11-7-15)14-22-19(16-4-2-1-3-5-16)17-8-12-21-13-9-17/h1-13,18-19,22-23H,14H2/t18-,19+/m0/s1
InChIKeyHOPGALFQMUCJKN-RBUKOAKNSA-N
XLogP2.89
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methylphenyl)-2-[[phenyl(pyridin-4-yl)methyl]amino]ethanol
CID 110010234
1-[[phenyl(pyridin-4-yl)methyl]amino]propan-2-ol
CID 43608190
(2R)-1-[[phenyl(pyridin-4-yl)methyl]amino]propan-2-ol
CID 113357070
(1S)-1-phenyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethanol
CID 93032010
1-methoxy-3-[[phenyl(pyridin-4-yl)methyl]amino]propan-2-ol
CID 63930265
(1R)-2-[[(S)-cyclohexyl(phenyl)methyl]amino]-1-pyridin-4-ylethanol
CID 97258708
(1S)-2-[[(R)-cyclohexyl(phenyl)methyl]amino]-1-pyridin-4-ylethanol
CID 97258709
2-methylsulfinyl-N-[phenyl(pyridin-4-yl)methyl]propan-1-amine
CID 115974879
2-[bis(trimethylsilyl)methylamino]-1-phenylethanol
CID 15425393
1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol
CID 43499221
(1R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]-1-phenylethanol
CID 902475
1-phenyl-2-(1-phenylethylamino)ethanol
CID 4665183

Frequently Asked Questions

What is the IUPAC name of (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol?
The IUPAC name of (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol (CID 99852293) is (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol.
What is the SMILES notation for (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol?
The canonical SMILES for (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol is O[C@@H](CN[C@H](c1ccccc1)c1ccncc1)c1ccncc1.
What is the InChIKey of (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol?
The InChIKey is HOPGALFQMUCJKN-RBUKOAKNSA-N. The full InChI is InChI=1S/C19H19N3O/c23-18(15-6-10-20-11-7-15)14-22-19(16-4-2-1-3-5-16)17-8-12-21-13-9-17/h1-13,18-19,22-23H,14H2/t18-,19+/m0/s1.
What are the key properties of (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol?
(1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol has a molecular weight of 305.38 g/mol, XLogP of 2.89, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-[[(R)-phenyl(pyridin-4-yl)methyl]amino]-1-pyridin-4-ylethanol is sourced from PubChem (CID 99852293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).