1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide

C22H28N2O2 — CID 75373922

IUPAC1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide
SMILESCOC(C)c1cccc(NC(=O)C2CCCCN2Cc2ccccc2)c1
InChIInChI=1S/C22H28N2O2/c1-17(26-2)19-11-8-12-20(15-19)23-22(25)21-13-6-7-14-24(21)16-18-9-4-3-5-10-18/h3-5,8-12,15,17,21H,6-7,13-14,16H2,1-2H3,(H,23,25)
InChIKeyGTCXZNIJGBHSSQ-UHFFFAOYSA-N
MW352.48 g/mol
LogP4.39
Rot. Bonds6

About 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide

1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide (PubChem CID 75373922) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide
PubChem CID75373922
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC Name1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide
SMILESCOC(C)c1cccc(NC(=O)C2CCCCN2Cc2ccccc2)c1
InChIInChI=1S/C22H28N2O2/c1-17(26-2)19-11-8-12-20(15-19)23-22(25)21-13-6-7-14-24(21)16-18-9-4-3-5-10-18/h3-5,8-12,15,17,21H,6-7,13-14,16H2,1-2H3,(H,23,25)
InChIKeyGTCXZNIJGBHSSQ-UHFFFAOYSA-N
XLogP4.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[3-[(1-benzylpiperidine-2-carbonyl)amino]phenyl]propanoic acid
CID 120613936
3-[[(2R)-1-benzylpyrrolidine-2-carbonyl]amino]benzoic acid
CID 97337283
(2R)-N-[3-(methoxymethyl)phenyl]-1-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 95308116
(2R)-N-[3-[methyl(propan-2-yl)amino]phenyl]-1-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 97314791
N-[3-[methyl(propan-2-yl)amino]phenyl]-1-(pyridin-4-ylmethyl)piperidine-2-carboxamide
CID 75463110
methyl 1-benzylpiperidine-2-carboxylate
CID 10443988
(2S)-1-benzyl-N-[3-(trifluoromethyl)phenyl]pyrrolidine-2-carboxamide
CID 39855223
1-benzyl-N-[3-methoxy-4-[(2-methoxyacetyl)amino]phenyl]piperidine-2-carboxamide
CID 131910005
N-(3-amino-4-methoxyphenyl)-1-benzylpyrrolidine-2-carboxamide;dihydrochloride
CID 119420472
1-benzyl-N-[3-(2,2,2-trifluoroethoxy)phenyl]pyrrolidine-2-carboxamide
CID 60579858
1-benzyl-N-[3-(3-methylanilino)-3-oxopropyl]piperidine-2-carboxamide
CID 131905339
(2S)-N-(3,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]piperidine-2-carboxamide
CID 1129906

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide?
The IUPAC name of 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide (CID 75373922) is 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide?
The canonical SMILES for 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide is COC(C)c1cccc(NC(=O)C2CCCCN2Cc2ccccc2)c1.
What is the InChIKey of 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide?
The InChIKey is GTCXZNIJGBHSSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-17(26-2)19-11-8-12-20(15-19)23-22(25)21-13-6-7-14-24(21)16-18-9-4-3-5-10-18/h3-5,8-12,15,17,21H,6-7,13-14,16H2,1-2H3,(H,23,25).
What are the key properties of 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide?
1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide has a molecular weight of 352.48 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-[3-(1-methoxyethyl)phenyl]piperidine-2-carboxamide is sourced from PubChem (CID 75373922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).