1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide

C18H26N2O3 — CID 113002396

IUPAC1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(C(=O)Cc2ccc(OC)cc2)CC1
InChIInChI=1S/C18H26N2O3/c1-3-10-19-18(22)15-8-11-20(12-9-15)17(21)13-14-4-6-16(23-2)7-5-14/h4-7,15H,3,8-13H2,1-2H3,(H,19,22)
InChIKeyTUWSZXDFPMVQFA-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.00
Rot. Bonds6

About 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide

1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide (PubChem CID 113002396) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide
PubChem CID113002396
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(C(=O)Cc2ccc(OC)cc2)CC1
InChIInChI=1S/C18H26N2O3/c1-3-10-19-18(22)15-8-11-20(12-9-15)17(21)13-14-4-6-16(23-2)7-5-14/h4-7,15H,3,8-13H2,1-2H3,(H,19,22)
InChIKeyTUWSZXDFPMVQFA-UHFFFAOYSA-N
XLogP2.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-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

1-[2-(4-methoxyphenyl)acetyl]-N-methylpiperidine-4-carboxamide
CID 46420386
N-[(4-methoxyphenyl)methyl]-1-[2-(4-methylphenyl)acetyl]piperidine-4-carboxamide
CID 113004350
N-butan-2-yl-1-[2-(4-methoxyphenyl)acetyl]piperidine-4-carboxamide
CID 113002840
1-(4-ethylpiperidin-1-yl)-2-(4-methoxyphenyl)ethanone
CID 67585408
2-(4-methoxyphenyl)-1-(4-methylpiperidin-1-yl)ethanone
CID 668771
N-(2-methoxyphenyl)-1-[2-(4-methoxyphenyl)acetyl]piperidine-4-carboxamide
CID 33344202
N-[2-(4-methoxyphenyl)ethyl]-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxamide
CID 55713699
1-[2-(4-fluorophenyl)acetyl]-N-[2-(3-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 113004740
1-[2-(4-methoxyphenyl)acetyl]-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 113006818
1-[2-(4-methoxyphenyl)acetyl]-N-(5-methyl-1,2-oxazol-3-yl)piperidine-4-carboxamide
CID 39700872
1-[2-(4-methoxyphenoxy)ethyl]-N-propylpiperidine-4-carboxamide
CID 134046333
1-[2-(4-methoxyphenyl)acetyl]pyrrolidine-3-carboxylic acid
CID 63006760

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide?
The IUPAC name of 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide (CID 113002396) is 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide?
The canonical SMILES for 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide is CCCNC(=O)C1CCN(C(=O)Cc2ccc(OC)cc2)CC1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide?
The InChIKey is TUWSZXDFPMVQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-3-10-19-18(22)15-8-11-20(12-9-15)17(21)13-14-4-6-16(23-2)7-5-14/h4-7,15H,3,8-13H2,1-2H3,(H,19,22).
What are the key properties of 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide?
1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide has a molecular weight of 318.42 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)acetyl]-N-propylpiperidine-4-carboxamide is sourced from PubChem (CID 113002396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).