N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide

C22H26N2O4 — CID 113007539

IUPACN-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C22H26N2O4/c1-3-28-20-10-5-4-9-19(20)23-21(25)16-11-13-24(14-12-16)22(26)17-7-6-8-18(15-17)27-2/h4-10,15-16H,3,11-14H2,1-2H3,(H,23,25)
InChIKeyZHDMJELTUHCEOG-UHFFFAOYSA-N
MW382.46 g/mol
LogP3.58
Rot. Bonds6

About N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide

N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide (PubChem CID 113007539) has the molecular formula C22H26N2O4 and a molecular weight of 382.46 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
PubChem CID113007539
Molecular FormulaC22H26N2O4
Molecular Weight382.46 g/mol
Exact Mass382.19
IUPAC NameN-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
SMILESCCOc1ccccc1NC(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C22H26N2O4/c1-3-28-20-10-5-4-9-19(20)23-21(25)16-11-13-24(14-12-16)22(26)17-7-6-8-18(15-17)27-2/h4-10,15-16H,3,11-14H2,1-2H3,(H,23,25)
InChIKeyZHDMJELTUHCEOG-UHFFFAOYSA-N
XLogP3.58
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.46
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methoxybenzoyl)-N-(2-propan-2-yloxyphenyl)piperidine-4-carboxamide
CID 113007631
N-(2-ethoxyphenyl)-1-(3,4,5-trimethoxybenzoyl)piperidine-4-carboxamide
CID 126021956
N-(2-chlorophenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
CID 113007109
N-(2-bromophenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide
CID 1245576
1-(4-tert-butylbenzoyl)-N-(2-ethoxyphenyl)piperidine-4-carboxamide
CID 126062025
N-(2-methoxyphenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 38646202
1-(3-cyanobenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 38646862
N-(2-methoxyphenyl)-1-[3-[3-(trifluoromethyl)phenoxy]benzoyl]piperidine-4-carboxamide
CID 33339548
1-(3,5-dimethoxybenzoyl)-N-(2-ethylphenyl)piperidine-4-carboxamide
CID 113006606
1-(3,5-dimethoxy-4-methylbenzoyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 33336070
1-[3-(cyclohexanecarbonylamino)benzoyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 33342519
4-N-(2-ethoxyphenyl)-1-N-(2-methoxyphenyl)cyclohexane-1,4-dicarboxamide
CID 109151014

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide (CID 113007539) is N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide is CCOc1ccccc1NC(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1.
What is the InChIKey of N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
The InChIKey is ZHDMJELTUHCEOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O4/c1-3-28-20-10-5-4-9-19(20)23-21(25)16-11-13-24(14-12-16)22(26)17-7-6-8-18(15-17)27-2/h4-10,15-16H,3,11-14H2,1-2H3,(H,23,25).
What are the key properties of N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide has a molecular weight of 382.46 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1-(3-methoxybenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 113007539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).