(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol

C15H24N2O — CID 103788675

IUPAC(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol
SMILESCC1CC(N[C@@H](CO)c2ccccc2)CCN1C
InChIInChI=1S/C15H24N2O/c1-12-10-14(8-9-17(12)2)16-15(11-18)13-6-4-3-5-7-13/h3-7,12,14-16,18H,8-11H2,1-2H3/t12?,14?,15-/m0/s1
InChIKeyQJVWMPCMITTWHY-ZALBZXLWSA-N
MW248.37 g/mol
LogP1.79
Rot. Bonds4

About (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol

(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol (PubChem CID 103788675) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol.

Molecular Properties

Compound Name(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol
PubChem CID103788675
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol
SMILESCC1CC(N[C@@H](CO)c2ccccc2)CCN1C
InChIInChI=1S/C15H24N2O/c1-12-10-14(8-9-17(12)2)16-15(11-18)13-6-4-3-5-7-13/h3-7,12,14-16,18H,8-11H2,1-2H3/t12?,14?,15-/m0/s1
InChIKeyQJVWMPCMITTWHY-ZALBZXLWSA-N
XLogP1.79
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(cyclopropylamino)-2-phenylethanol
CID 93471499
(2S)-2-[[1-(2-methylpropyl)piperidin-4-yl]amino]-2-phenylethanol
CID 103783988
2-[(3-ethylcyclopentyl)amino]-2-phenylethanol
CID 64500919
N-[furan-2-yl(phenyl)methyl]-1,2-dimethylpiperidin-4-amine
CID 81296842
(2S)-2-[(3-aminocyclopentyl)amino]-2-phenylethanol
CID 107862243
(2S)-2-[[1-(3-methylbut-2-enyl)piperidin-4-yl]amino]-2-phenylethanol
CID 103784052
2-[[1-(4-aminobutan-2-yl)piperidin-4-yl]amino]-2-phenylethanol
CID 68776969
(2S)-2-phenyl-2-[(4-propan-2-ylcyclohexyl)amino]ethanol
CID 103784113
3-amino-N-(1,2-dimethylpiperidin-4-yl)-2-methyl-3-phenylpropanamide
CID 81494459
(2R)-2-phenyl-2-[(3,3,5-trimethylcyclohexyl)amino]ethanol
CID 103788694
(2R)-2-(2,3-dihydro-1H-inden-2-ylamino)-2-phenylethanol
CID 103788767
tert-butyl N-[3-[[(1R)-2-hydroxy-1-phenylethyl]amino]cyclopentyl]carbamate
CID 107862557

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol?
The IUPAC name of (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol (CID 103788675) is (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol.
What is the SMILES notation for (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol?
The canonical SMILES for (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol is CC1CC(N[C@@H](CO)c2ccccc2)CCN1C.
What is the InChIKey of (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol?
The InChIKey is QJVWMPCMITTWHY-ZALBZXLWSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-10-14(8-9-17(12)2)16-15(11-18)13-6-4-3-5-7-13/h3-7,12,14-16,18H,8-11H2,1-2H3/t12?,14?,15-/m0/s1.
What are the key properties of (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol?
(2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol has a molecular weight of 248.37 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(1,2-dimethylpiperidin-4-yl)amino]-2-phenylethanol is sourced from PubChem (CID 103788675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).