1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol

C15H18N2O — CID 81407252

IUPAC1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
SMILESC[C@@H](NCC(O)c1ccccc1)c1ccccn1
InChIInChI=1S/C15H18N2O/c1-12(14-9-5-6-10-16-14)17-11-15(18)13-7-3-2-4-8-13/h2-10,12,15,17-18H,11H2,1H3/t12-,15?/m1/s1
InChIKeyMMFPDPAETPDXNU-KEKZHRQWSA-N
MW242.32 g/mol
LogP2.47
Rot. Bonds5

About 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol

1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol (PubChem CID 81407252) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol.

Molecular Properties

Compound Name1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
PubChem CID81407252
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
SMILESC[C@@H](NCC(O)c1ccccc1)c1ccccn1
InChIInChI=1S/C15H18N2O/c1-12(14-9-5-6-10-16-14)17-11-15(18)13-7-3-2-4-8-13/h2-10,12,15,17-18H,11H2,1H3/t12-,15?/m1/s1
InChIKeyMMFPDPAETPDXNU-KEKZHRQWSA-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

1-phenyl-2-(1-pyridin-2-ylethylamino)ethanol
CID 43394637
1-(4-chlorophenyl)-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol
CID 81406911
1-(4-fluorophenyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]ethanol
CID 81401380
1-(1-pyridin-2-ylethylamino)propan-2-ol
CID 43499405
1-[4-(difluoromethoxy)phenyl]-2-(1-pyridin-2-ylethylamino)ethanol
CID 110902098
2-(1-pyridin-2-ylethylamino)-1-[3-(trifluoromethyl)phenyl]ethanol
CID 110896910
1-phenyl-2-(1-phenylethylamino)ethanol
CID 4665183
(1S)-1-phenyl-2-(1-phenylethylamino)ethanol
CID 70464051
1-[[(1S)-1-pyridin-2-ylethyl]amino]butan-2-ol
CID 81401299
(1S)-1-phenyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethanol
CID 93032010
1-phenoxy-3-[[(1S)-1-pyridin-2-ylethyl]amino]propan-2-ol
CID 81402245
3-[[(1R)-1-pyridin-2-ylethyl]amino]propanoic acid
CID 81406743

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
The IUPAC name of 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol (CID 81407252) is 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol.
What is the SMILES notation for 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
The canonical SMILES for 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol is C[C@@H](NCC(O)c1ccccc1)c1ccccn1.
What is the InChIKey of 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
The InChIKey is MMFPDPAETPDXNU-KEKZHRQWSA-N. The full InChI is InChI=1S/C15H18N2O/c1-12(14-9-5-6-10-16-14)17-11-15(18)13-7-3-2-4-8-13/h2-10,12,15,17-18H,11H2,1H3/t12-,15?/m1/s1.
What are the key properties of 1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol?
1-phenyl-2-[[(1R)-1-pyridin-2-ylethyl]amino]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-[[(1R)-1-pyridin-2-ylethyl]amino]ethanol is sourced from PubChem (CID 81407252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).