(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol

C14H19NO — CID 10680302

IUPAC(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol
SMILESC[C@@H]1C=CCCN1[C@@H](CO)c1ccccc1
InChIInChI=1S/C14H19NO/c1-12-7-5-6-10-15(12)14(11-16)13-8-3-2-4-9-13/h2-5,7-9,12,14,16H,6,10-11H2,1H3/t12-,14+/m1/s1
InChIKeyLDOHNMDPBCRIBJ-OCCSQVGLSA-N
MW217.31 g/mol
LogP2.37
Rot. Bonds3

About (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol

(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol (PubChem CID 10680302) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol
PubChem CID10680302
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol
SMILESC[C@@H]1C=CCCN1[C@@H](CO)c1ccccc1
InChIInChI=1S/C14H19NO/c1-12-7-5-6-10-15(12)14(11-16)13-8-3-2-4-9-13/h2-5,7-9,12,14,16H,6,10-11H2,1H3/t12-,14+/m1/s1
InChIKeyLDOHNMDPBCRIBJ-OCCSQVGLSA-N
XLogP2.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(2-methylazetidin-1-yl)-2-phenylethanol
CID 104549553
(2R)-2-[(2R,3R)-3-(hydroxymethyl)-2-methylpiperidin-1-yl]-2-phenylethanol
CID 143702380
2-(3-ethylazetidin-1-yl)-2-phenylethanol
CID 104549564
(2S)-2-[(2S)-2-ethylpiperidin-1-yl]-2-phenylethanol
CID 10609696
(2S)-2-[(2S,3R)-3-(tert-butylamino)-2-methylpyrrolidin-1-yl]-2-phenylethanol
CID 10446176
(2R)-2-[(2S,6S)-2-[2-(1,3-dioxolan-2-yl)ethyl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol
CID 10734278
(2S)-2-phenyl-2-[(2S)-2-propylpiperidin-1-yl]ethanol
CID 10490739
(2R)-2-[(4S)-4-ethyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl]-2-phenylethanol
CID 42600019
(6S)-6-benzyl-1-[(1S)-1-phenylethyl]-3,6-dihydro-2H-pyridine
CID 10588595
1-[(1R)-2-hydroxy-1-phenylethyl]-4-methylpiperidine-2,6-dione
CID 95027251
(5S)-1-(2-hydroxy-1-phenylethyl)-5-methylpiperidin-2-one
CID 175215749
(2R)-2-[(2S)-2-pentylpiperidin-1-yl]-2-phenylethanol
CID 10636143

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol?
The IUPAC name of (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol (CID 10680302) is (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol is C[C@@H]1C=CCCN1[C@@H](CO)c1ccccc1.
What is the InChIKey of (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol?
The InChIKey is LDOHNMDPBCRIBJ-OCCSQVGLSA-N. The full InChI is InChI=1S/C14H19NO/c1-12-7-5-6-10-15(12)14(11-16)13-8-3-2-4-9-13/h2-5,7-9,12,14,16H,6,10-11H2,1H3/t12-,14+/m1/s1.
What are the key properties of (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol?
(2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol has a molecular weight of 217.31 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(6R)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-2-phenylethanol is sourced from PubChem (CID 10680302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).