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

C20H28N2O3 — CID 110820511

IUPACN-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCOc1ccccc1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H28N2O3/c1-25-18-10-6-5-9-17(18)20(24)22-13-11-16(12-14-22)21-19(23)15-7-3-2-4-8-15/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H,21,23)
InChIKeyPSATYNCOEWOIKK-UHFFFAOYSA-N
MW344.45 g/mol
LogP3.00
Rot. Bonds4

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

N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide (PubChem CID 110820511) has the molecular formula C20H28N2O3 and a molecular weight of 344.45 g/mol. Its IUPAC name is N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
PubChem CID110820511
Molecular FormulaC20H28N2O3
Molecular Weight344.45 g/mol
Exact Mass344.21
IUPAC NameN-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
SMILESCOc1ccccc1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1
InChIInChI=1S/C20H28N2O3/c1-25-18-10-6-5-9-17(18)20(24)22-13-11-16(12-14-22)21-19(23)15-7-3-2-4-8-15/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H,21,23)
InChIKeyPSATYNCOEWOIKK-UHFFFAOYSA-N
XLogP3.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.45
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-3-[1-(2-methoxybenzoyl)piperidin-4-yl]urea
CID 127232346
N-cyclopropyl-1-[1-(2-methoxybenzoyl)piperidin-4-yl]piperidine-3-carboxamide
CID 56867909
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 51096408
N-[1-(2-fluorobenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820345
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820253
2-chloro-N-[1-(2-methoxybenzoyl)piperidin-4-yl]acetamide
CID 108563596
1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 1072829
N-[1-(2-hydroxy-4-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 51127230
N-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-(2-methoxyphenoxy)acetamide
CID 108556653
1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
CID 1072799
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]benzoic acid
CID 113083284

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The IUPAC name of N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide (CID 110820511) is N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide.
What is the SMILES notation for N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The canonical SMILES for N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide is COc1ccccc1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1.
What is the InChIKey of N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
The InChIKey is PSATYNCOEWOIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N2O3/c1-25-18-10-6-5-9-17(18)20(24)22-13-11-16(12-14-22)21-19(23)15-7-3-2-4-8-15/h5-6,9-10,15-16H,2-4,7-8,11-14H2,1H3,(H,21,23).
What are the key properties of N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide?
N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide has a molecular weight of 344.45 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide is sourced from PubChem (CID 110820511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).