1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol

C15H18N2O — CID 43499221

IUPAC1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol
SMILESCC(NCC(O)c1ccccc1)c1cccnc1
InChIInChI=1S/C15H18N2O/c1-12(14-8-5-9-16-10-14)17-11-15(18)13-6-3-2-4-7-13/h2-10,12,15,17-18H,11H2,1H3
InChIKeyCHGQFEKGSIAWBK-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.47
Rot. Bonds5

About 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol

1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol (PubChem CID 43499221) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol.

Molecular Properties

Compound Name1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol
PubChem CID43499221
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol
SMILESCC(NCC(O)c1ccccc1)c1cccnc1
InChIInChI=1S/C15H18N2O/c1-12(14-8-5-9-16-10-14)17-11-15(18)13-6-3-2-4-7-13/h2-10,12,15,17-18H,11H2,1H3
InChIKeyCHGQFEKGSIAWBK-UHFFFAOYSA-N
XLogP2.47
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(4-methylphenyl)-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethanol
CID 97158238
(2S)-1-[[(1S)-1-pyridin-3-ylethyl]amino]propan-2-ol
CID 93082162
4-[1-hydroxy-2-[[(1S)-1-pyridin-3-ylethyl]amino]ethyl]benzonitrile
CID 81403976
(1S)-1-phenyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethanol
CID 93032010
1-phenyl-2-(1-phenylethylamino)ethanol
CID 4665183
(1S)-1-phenyl-2-(1-phenylethylamino)ethanol
CID 70464051
1-(4-nitrophenyl)-2-(1-pyridin-3-ylethylamino)ethanol
CID 78956198
3-[[(1S)-1-pyridin-3-ylethyl]amino]propanoic acid
CID 81404422
2-amino-3-[[(1R)-1-pyridin-3-ylethyl]amino]propanoic acid
CID 103258248
1-phenylmethoxy-3-[[(1R)-1-pyridin-3-ylethyl]amino]propan-2-ol
CID 81393836
1-phenyl-2-[1-(4-propan-2-ylphenyl)ethylamino]ethanol
CID 43388825
1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
CID 81407252

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol?
The IUPAC name of 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol (CID 43499221) is 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol.
What is the SMILES notation for 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol?
The canonical SMILES for 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol is CC(NCC(O)c1ccccc1)c1cccnc1.
What is the InChIKey of 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol?
The InChIKey is CHGQFEKGSIAWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12(14-8-5-9-16-10-14)17-11-15(18)13-6-3-2-4-7-13/h2-10,12,15,17-18H,11H2,1H3.
What are the key properties of 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol?
1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol has a molecular weight of 242.32 g/mol, XLogP of 2.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol is sourced from PubChem (CID 43499221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).