N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide

C23H30N2O2 — CID 78833941

IUPACN-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide
SMILESCCN(Cc1ccccc1)C(=O)C(C)N1CCC(c2ccc(O)cc2)CC1
InChIInChI=1S/C23H30N2O2/c1-3-24(17-19-7-5-4-6-8-19)23(27)18(2)25-15-13-21(14-16-25)20-9-11-22(26)12-10-20/h4-12,18,21,26H,3,13-17H2,1-2H3
InChIKeyOYMHKAMOUBAJAP-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.01
Rot. Bonds6

About N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide

N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide (PubChem CID 78833941) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide
PubChem CID78833941
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide
SMILESCCN(Cc1ccccc1)C(=O)C(C)N1CCC(c2ccc(O)cc2)CC1
InChIInChI=1S/C23H30N2O2/c1-3-24(17-19-7-5-4-6-8-19)23(27)18(2)25-15-13-21(14-16-25)20-9-11-22(26)12-10-20/h4-12,18,21,26H,3,13-17H2,1-2H3
InChIKeyOYMHKAMOUBAJAP-UHFFFAOYSA-N
XLogP4.01
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 ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-ethyl-2-(4-hydroxypiperidin-1-yl)propanamide
CID 110877676
N-benzyl-N-methyl-2-(4-methylpiperidin-1-yl)propanamide
CID 134062840
N-benzyl-N-ethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
CID 84591484
2,4-bis(4-phenylpiperidin-1-yl)pentan-3-one
CID 174394805
(2S)-N-benzyl-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-N-ethylpropanamide
CID 9399043
N-(2-cyanoethyl)-N-methyl-2-(4-phenylpiperidin-1-yl)propanamide
CID 86921194
(2S)-2-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-N-benzyl-N-methylpropanamide
CID 9356997
(2S)-N-benzyl-N-ethyl-2-[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]propanamide
CID 27125596
N-[1-[4-(4-hydroxyphenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-phenylacetamide
CID 51327509
N-benzyl-2-bromo-N-ethylpropanamide
CID 82108939
N-benzyl-N-methyl-2-(4-phenylpiperazin-1-yl)propanamide
CID 42858943
N,N-diethyl-1-[1-[(3-fluorophenyl)methyl-methylamino]-1-oxopropan-2-yl]piperidine-4-carboxamide
CID 86870583

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide?
The IUPAC name of N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide (CID 78833941) is N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide.
What is the SMILES notation for N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide?
The canonical SMILES for N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide is CCN(Cc1ccccc1)C(=O)C(C)N1CCC(c2ccc(O)cc2)CC1.
What is the InChIKey of N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide?
The InChIKey is OYMHKAMOUBAJAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-3-24(17-19-7-5-4-6-8-19)23(27)18(2)25-15-13-21(14-16-25)20-9-11-22(26)12-10-20/h4-12,18,21,26H,3,13-17H2,1-2H3.
What are the key properties of N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide?
N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide has a molecular weight of 366.51 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]propanamide is sourced from PubChem (CID 78833941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).