N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide

C23H30N2O2 — CID 24843770

IUPACN-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide
SMILESCCC(=O)N(c1ccccc1)C1CCN(C(C)C(O)c2ccccc2)CC1
InChIInChI=1S/C23H30N2O2/c1-3-22(26)25(20-12-8-5-9-13-20)21-14-16-24(17-15-21)18(2)23(27)19-10-6-4-7-11-19/h4-13,18,21,23,27H,3,14-17H2,1-2H3
InChIKeyVEXQKVNLLLBGEO-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.02
Rot. Bonds6

About N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide

N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide (PubChem CID 24843770) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide.

Molecular Properties

Compound NameN-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide
PubChem CID24843770
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide
SMILESCCC(=O)N(c1ccccc1)C1CCN(C(C)C(O)c2ccccc2)CC1
InChIInChI=1S/C23H30N2O2/c1-3-22(26)25(20-12-8-5-9-13-20)21-14-16-24(17-15-21)18(2)23(27)19-10-6-4-7-11-19/h4-13,18,21,23,27H,3,14-17H2,1-2H3
InChIKeyVEXQKVNLLLBGEO-UHFFFAOYSA-N
XLogP4.02
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide?
The IUPAC name of N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide (CID 24843770) is N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide.
What is the SMILES notation for N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide?
The canonical SMILES for N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide is CCC(=O)N(c1ccccc1)C1CCN(C(C)C(O)c2ccccc2)CC1.
What is the InChIKey of N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide?
The InChIKey is VEXQKVNLLLBGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-3-22(26)25(20-12-8-5-9-13-20)21-14-16-24(17-15-21)18(2)23(27)19-10-6-4-7-11-19/h4-13,18,21,23,27H,3,14-17H2,1-2H3.
What are the key properties of N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide?
N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide has a molecular weight of 366.51 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-hydroxy-1-phenylpropan-2-yl)piperidin-4-yl]-N-phenylpropanamide is sourced from PubChem (CID 24843770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).