2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide

C17H26N2O2 — CID 154414410

IUPAC2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide
SMILESCC(c1ccccc1)N1CCC(O)(C(C)(C)C(N)=O)CC1
InChIInChI=1S/C17H26N2O2/c1-13(14-7-5-4-6-8-14)19-11-9-17(21,10-12-19)16(2,3)15(18)20/h4-8,13,21H,9-12H2,1-3H3,(H2,18,20)
InChIKeyCKSJNOFYIHSJGK-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.09
Rot. Bonds4

About 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide

2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide (PubChem CID 154414410) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide.

Molecular Properties

Compound Name2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide
PubChem CID154414410
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide
SMILESCC(c1ccccc1)N1CCC(O)(C(C)(C)C(N)=O)CC1
InChIInChI=1S/C17H26N2O2/c1-13(14-7-5-4-6-8-14)19-11-9-17(21,10-12-19)16(2,3)15(18)20/h4-8,13,21H,9-12H2,1-3H3,(H2,18,20)
InChIKeyCKSJNOFYIHSJGK-UHFFFAOYSA-N
XLogP2.09
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Piperidinol, 4-(1-carbamoylpropyl)-1-(1,2,3,4-tetrahydro-2-naphthyl)-
CID 3040614
N-cyclohexyl-2-[4-hydroxy-1-(2-phenylethyl)piperidin-4-yl]-N-methylpropanamide;hydrochloride
CID 13061483
2-(1-benzyl-4-hydroxypiperidin-4-yl)-N-cyclohexyl-N-methylpropanamide;hydrochloride
CID 49860892
(3R*,4S*)-1-[(1-benzyl-4-piperidinyl)acetyl]-3,4-dimethyl-4-piperidinol
CID 72867068
1-(9-Benzyl-3,9-diazaspiro[5.5]undecan-3-yl)-3-hydroxy-3-methylbutan-1-one
CID 126834621
2-[1-[1-(4-fluorophenyl)-4-oxobutyl]-4-hydroxypiperidin-4-yl]-N,N-dimethylpropanamide
CID 20293529
1-[2-(4-Fluoro-2-methylphenyl)piperidin-1-yl]-3-hydroxy-3-methylbutan-1-one
CID 143163497
N-cyclohexyl-2-[1-[1-(2-fluorophenyl)ethyl]-4-hydroxypiperidin-4-yl]-N-methylpropanamide
CID 172766237
(3R,4R)-1-benzyl-4-hydroxy-3,4-dimethylpiperidin-2-one
CID 101405670
2-(1-benzyl-4-hydroxypiperidin-4-yl)-N-cyclohexyl-N-methylpropanamide
CID 13061433
N-cyclohexyl-2-[4-hydroxy-1-(2-phenylethyl)piperidin-4-yl]-N-methylpropanamide
CID 13061482
2-[1-[(4-ethylphenyl)methyl]-4-hydroxypiperidin-4-yl]-2,2-difluoro-N-methylacetamide
CID 139014404

Frequently Asked Questions

What is the IUPAC name of 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide?
The IUPAC name of 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide (CID 154414410) is 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide.
What is the SMILES notation for 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide?
The canonical SMILES for 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide is CC(c1ccccc1)N1CCC(O)(C(C)(C)C(N)=O)CC1.
What is the InChIKey of 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide?
The InChIKey is CKSJNOFYIHSJGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(14-7-5-4-6-8-14)19-11-9-17(21,10-12-19)16(2,3)15(18)20/h4-8,13,21H,9-12H2,1-3H3,(H2,18,20).
What are the key properties of 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide?
2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide has a molecular weight of 290.41 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-hydroxy-1-(1-phenylethyl)piperidin-4-yl]-2-methylpropanamide is sourced from PubChem (CID 154414410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).