N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide

C26H32N2O4 — CID 162790486

IUPACN-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide
SMILESCC1(O)CCN(C(=O)COc2ccccc2)C(c2ccccc2)C1NC(=O)C1CCCC1
InChIInChI=1S/C26H32N2O4/c1-26(31)16-17-28(22(29)18-32-21-14-6-3-7-15-21)23(19-10-4-2-5-11-19)24(26)27-25(30)20-12-8-9-13-20/h2-7,10-11,14-15,20,23-24,31H,8-9,12-13,16-18H2,1H3,(H,27,30)
InChIKeyQEQHTRNQKSXOMI-UHFFFAOYSA-N
MW436.55 g/mol
LogP3.46
Rot. Bonds6

About N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide

N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide (PubChem CID 162790486) has the molecular formula C26H32N2O4 and a molecular weight of 436.55 g/mol. Its IUPAC name is N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide
PubChem CID162790486
Molecular FormulaC26H32N2O4
Molecular Weight436.55 g/mol
Exact Mass436.24
IUPAC NameN-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide
SMILESCC1(O)CCN(C(=O)COc2ccccc2)C(c2ccccc2)C1NC(=O)C1CCCC1
InChIInChI=1S/C26H32N2O4/c1-26(31)16-17-28(22(29)18-32-21-14-6-3-7-15-21)23(19-10-4-2-5-11-19)24(26)27-25(30)20-12-8-9-13-20/h2-7,10-11,14-15,20,23-24,31H,8-9,12-13,16-18H2,1H3,(H,27,30)
InChIKeyQEQHTRNQKSXOMI-UHFFFAOYSA-N
XLogP3.46
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.55
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-hydroxy-4-methyl-2-phenyl-1-propylpiperidin-3-yl)cyclopentanecarboxamide
CID 162968981
N-(1-benzyl-4-hydroxy-4-methyl-2-phenylpiperidin-3-yl)cyclopentanecarboxamide
CID 162801614
N-[1-(3,3-dimethylbutyl)-4-hydroxy-4-methyl-2-phenylpiperidin-3-yl]cyclopentanecarboxamide
CID 162933425
3-(cyclopropanecarbonylamino)-4-hydroxy-4-methyl-2-phenyl-N-propylpiperidine-1-carboxamide
CID 162790473
N-[1-(cyclohexanecarbonyl)-4-hydroxy-4-methyl-2-phenylpiperidin-3-yl]acetamide
CID 162790470
N-[1-(benzenesulfonyl)-4-hydroxy-4-methyl-2-phenylpiperidin-3-yl]cyclopentanecarboxamide
CID 162790730
N-[4-hydroxy-4-methyl-2-phenyl-1-(pyrimidin-5-ylmethyl)piperidin-3-yl]cyclopentanecarboxamide
CID 162790477
N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-thiophen-2-ylpiperidin-3-yl]benzamide
CID 162790727
N-[4-hydroxy-4-methyl-2-phenyl-1-(3-phenylpropyl)piperidin-3-yl]cyclopropanecarboxamide
CID 162907254
(2R)-N-benzyl-1-(2-phenoxyacetyl)piperidine-2-carboxamide
CID 118738129
N'-(2-phenoxyacetyl)cyclohexanecarbohydrazide
CID 695727
1-(2-cyclopropylpyrrolidin-1-yl)-2-phenoxyethanone
CID 110871787

Frequently Asked Questions

What is the IUPAC name of N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide?
The IUPAC name of N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide (CID 162790486) is N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide is CC1(O)CCN(C(=O)COc2ccccc2)C(c2ccccc2)C1NC(=O)C1CCCC1.
What is the InChIKey of N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide?
The InChIKey is QEQHTRNQKSXOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N2O4/c1-26(31)16-17-28(22(29)18-32-21-14-6-3-7-15-21)23(19-10-4-2-5-11-19)24(26)27-25(30)20-12-8-9-13-20/h2-7,10-11,14-15,20,23-24,31H,8-9,12-13,16-18H2,1H3,(H,27,30).
What are the key properties of N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide?
N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide has a molecular weight of 436.55 g/mol, XLogP of 3.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-hydroxy-4-methyl-1-(2-phenoxyacetyl)-2-phenylpiperidin-3-yl]cyclopentanecarboxamide is sourced from PubChem (CID 162790486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).