N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide

C22H26N2O3 — CID 113006521

IUPACN-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide
SMILESCOc1ccccc1C(=O)N1CCC(C(=O)Nc2c(C)cccc2C)CC1
InChIInChI=1S/C22H26N2O3/c1-15-7-6-8-16(2)20(15)23-21(25)17-11-13-24(14-12-17)22(26)18-9-4-5-10-19(18)27-3/h4-10,17H,11-14H2,1-3H3,(H,23,25)
InChIKeyHYKMBCALAFQEJQ-UHFFFAOYSA-N
MW366.46 g/mol
LogP3.80
Rot. Bonds4

About N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide

N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide (PubChem CID 113006521) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide
PubChem CID113006521
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide
SMILESCOc1ccccc1C(=O)N1CCC(C(=O)Nc2c(C)cccc2C)CC1
InChIInChI=1S/C22H26N2O3/c1-15-7-6-8-16(2)20(15)23-21(25)17-11-13-24(14-12-17)22(26)18-9-4-5-10-19(18)27-3/h4-10,17H,11-14H2,1-3H3,(H,23,25)
InChIKeyHYKMBCALAFQEJQ-UHFFFAOYSA-N
XLogP3.80
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dimethylphenyl)-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 17019038
(2-methoxyphenyl)-(4-methylpiperidin-1-yl)methanone
CID 5149560
N-(5-tert-butyl-2-methoxyphenyl)-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 7935911
N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820511
methyl 1-(2-methoxybenzoyl)pyrrolidine-3-carboxylate
CID 84581536
N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113006519
1-(2-fluorobenzoyl)-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide
CID 17019069
N-[(Z)-(2-methoxyphenyl)methylideneamino]-1-(2-methylbenzoyl)piperidine-4-carboxamide
CID 126013213
1-(2-methoxybenzoyl)-N-[(3-methyl-2-pyridinyl)-phenylmethyl]piperidine-4-carboxamide
CID 126473277
N-(2,6-dimethylphenyl)-1-phenylpiperidine-4-carboxamide
CID 17152337
(2-methoxyphenyl)-[4-(methylaminomethyl)piperidin-1-yl]methanone
CID 63248507
[2-(2-methoxyphenyl)-2-oxoethyl] 1-(2-methylbenzoyl)piperidine-4-carboxylate
CID 7739829

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide (CID 113006521) is N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide is COc1ccccc1C(=O)N1CCC(C(=O)Nc2c(C)cccc2C)CC1.
What is the InChIKey of N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide?
The InChIKey is HYKMBCALAFQEJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O3/c1-15-7-6-8-16(2)20(15)23-21(25)17-11-13-24(14-12-17)22(26)18-9-4-5-10-19(18)27-3/h4-10,17H,11-14H2,1-3H3,(H,23,25).
What are the key properties of N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide?
N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide has a molecular weight of 366.46 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-1-(2-methoxybenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 113006521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).