N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide

C21H24N2O3 — CID 38646202

IUPACN-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(C(=O)c2cccc(C)c2)CC1
InChIInChI=1S/C21H24N2O3/c1-15-6-5-7-17(14-15)21(25)23-12-10-16(11-13-23)20(24)22-18-8-3-4-9-19(18)26-2/h3-9,14,16H,10-13H2,1-2H3,(H,22,24)
InChIKeyHQKGWKGSNNRYQB-UHFFFAOYSA-N
MW352.43 g/mol
LogP3.49
Rot. Bonds4

About N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide

N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide (PubChem CID 38646202) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
PubChem CID38646202
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC NameN-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
SMILESCOc1ccccc1NC(=O)C1CCN(C(=O)c2cccc(C)c2)CC1
InChIInChI=1S/C21H24N2O3/c1-15-6-5-7-17(14-15)21(25)23-12-10-16(11-13-23)20(24)22-18-8-3-4-9-19(18)26-2/h3-9,14,16H,10-13H2,1-2H3,(H,22,24)
InChIKeyHQKGWKGSNNRYQB-UHFFFAOYSA-N
XLogP3.49
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxy-5-methylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113007595
1-(3,5-dimethoxy-4-methylbenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 33336070
methyl 2-[[1-(3-methylbenzoyl)piperidine-4-carbonyl]amino]benzoate
CID 113007945
1-[3-(cyclohexanecarbonylamino)benzoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 33342519
1-(3-cyanobenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 38646862
N-(2-methoxyphenyl)-1-[3-[(2-methylcyclopropanecarbonyl)amino]benzoyl]piperidine-4-carboxamide
CID 46432087
1-(4-chlorobenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 2295609
1-acetyl-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 6468496
N-(2-methoxyphenyl)-1-[3-[3-(trifluoromethyl)phenoxy]benzoyl]piperidine-4-carboxamide
CID 33339548
1-(3-methoxybenzoyl)-N-(2-propan-2-yloxyphenyl)piperidine-4-carboxamide
CID 113007631
N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
CID 113007539
N-(2,6-dimethylphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113006519

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide (CID 38646202) is N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide is COc1ccccc1NC(=O)C1CCN(C(=O)c2cccc(C)c2)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
The InChIKey is HQKGWKGSNNRYQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O3/c1-15-6-5-7-17(14-15)21(25)23-12-10-16(11-13-23)20(24)22-18-8-3-4-9-19(18)26-2/h3-9,14,16H,10-13H2,1-2H3,(H,22,24).
What are the key properties of N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide?
N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide has a molecular weight of 352.43 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 38646202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).