N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide

C20H28N2O4 — CID 51127230

IUPACN-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCOc1ccc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)c(O)c1
InChIInChI=1S/C20H28N2O4/c1-26-16-7-8-17(18(23)13-16)20(25)22-11-9-15(10-12-22)21-19(24)14-5-3-2-4-6-14/h7-8,13-15,23H,2-6,9-12H2,1H3,(H,21,24)
InChIKeyICDMZCNJVHOTQB-UHFFFAOYSA-N
MW360.45 g/mol
LogP2.70
Rot. Bonds4

About N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide

N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide (PubChem CID 51127230) has the molecular formula C20H28N2O4 and a molecular weight of 360.45 g/mol. Its IUPAC name is N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
PubChem CID51127230
Molecular FormulaC20H28N2O4
Molecular Weight360.45 g/mol
Exact Mass360.20
IUPAC NameN-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCOc1ccc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)c(O)c1
InChIInChI=1S/C20H28N2O4/c1-26-16-7-8-17(18(23)13-16)20(25)22-11-9-15(10-12-22)21-19(24)14-5-3-2-4-6-14/h7-8,13-15,23H,2-6,9-12H2,1H3,(H,21,24)
InChIKeyICDMZCNJVHOTQB-UHFFFAOYSA-N
XLogP2.70
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.45
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820511
(2-hydroxy-4-methoxyphenyl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103711808
N'-hydroxy-1-(2-hydroxy-4-methoxybenzoyl)piperidine-4-carboximidamide
CID 77038522
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 51096408
N-[1-(3,4,5-trihydroxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 108549958
N-(1,3-benzodioxol-5-yl)-1-(2-hydroxy-4-methoxybenzoyl)piperidine-4-carboxamide
CID 41410485
N-[1-(2-fluorobenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820345
N-cyclohexyl-1-[1-(3-methoxybenzoyl)piperidin-4-yl]piperidine-4-carboxamide
CID 42693267
[2-(bromomethyl)piperidin-1-yl]-(2-hydroxy-4-methoxyphenyl)methanone
CID 80659061
4-N-cyclohexyl-1-N-(4-methoxyphenyl)piperidine-1,4-dicarboxamide
CID 6486998
N-cyclopropyl-1-(3,5-dimethoxybenzoyl)piperidine-4-carboxamide
CID 113002527
(2-hydroxy-4-methoxyphenyl)-(4-hydroxy-4-methylazepan-1-yl)methanone
CID 107404889

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide (CID 51127230) is N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide is COc1ccc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)c(O)c1.
What is the InChIKey of N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is ICDMZCNJVHOTQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O4/c1-26-16-7-8-17(18(23)13-16)20(25)22-11-9-15(10-12-22)21-19(24)14-5-3-2-4-6-14/h7-8,13-15,23H,2-6,9-12H2,1H3,(H,21,24).
What are the key properties of N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 360.45 g/mol, XLogP of 2.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 51127230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).