N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide

C23H28N2O3 — CID 113004395

IUPACN-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C23H28N2O3/c1-3-24(17-18-8-5-4-6-9-18)22(26)19-12-14-25(15-13-19)23(27)20-10-7-11-21(16-20)28-2/h4-11,16,19H,3,12-15,17H2,1-2H3
InChIKeyHTDXSRXEABMFPP-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.60
Rot. Bonds6

About N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide

N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide (PubChem CID 113004395) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide
PubChem CID113004395
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC NameN-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1
InChIInChI=1S/C23H28N2O3/c1-3-24(17-18-8-5-4-6-9-18)22(26)19-12-14-25(15-13-19)23(27)20-10-7-11-21(16-20)28-2/h4-11,16,19H,3,12-15,17H2,1-2H3
InChIKeyHTDXSRXEABMFPP-UHFFFAOYSA-N
XLogP3.60
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-ethyl-1-[(3-methoxyphenyl)methyl]piperidine-4-carboxamide;oxalic acid
CID 44828320
N-benzyl-N-ethyl-1-(3-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 71737574
methyl 3-[benzyl-[1-(3,5-dimethoxybenzoyl)piperidine-4-carbonyl]amino]propanoate
CID 55758858
methyl 4-[benzyl(ethyl)carbamoyl]piperidine-1-carboxylate
CID 110754107
N-benzyl-N-ethyl-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-4-carboxamide
CID 7279394
1-acetyl-N-benzyl-N-ethylpiperidine-4-carboxamide
CID 110686023
N-benzyl-N-ethyl-1-(3-phenoxypropanoyl)piperidine-4-carboxamide
CID 113004404
N-[1-(3-methoxybenzoyl)piperidin-4-yl]-2-phenylacetamide
CID 108551244
(4-methoxyphenyl)-[1-(3-phenylmethoxybenzoyl)piperidin-4-yl]methanone
CID 25472791
N-benzyl-N-ethyl-1-[2-(3-methylphenyl)acetyl]piperidine-4-carboxamide
CID 113004413
1-benzylsulfonyl-N-ethyl-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
CID 55690537
1-benzoyl-N-[2-hydroxy-2-(3-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
CID 110308753

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide (CID 113004395) is N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide is CCN(Cc1ccccc1)C(=O)C1CCN(C(=O)c2cccc(OC)c2)CC1.
What is the InChIKey of N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
The InChIKey is HTDXSRXEABMFPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-3-24(17-18-8-5-4-6-9-18)22(26)19-12-14-25(15-13-19)23(27)20-10-7-11-21(16-20)28-2/h4-11,16,19H,3,12-15,17H2,1-2H3.
What are the key properties of N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide?
N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 3.60, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-1-(3-methoxybenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 113004395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).