N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide

C23H30N2O2 — CID 10384292

IUPACN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(N(CCC2CCN(Cc3ccccc3)CC2)C(C)=O)c1
InChIInChI=1S/C23H30N2O2/c1-19(26)25(22-9-6-10-23(17-22)27-2)16-13-20-11-14-24(15-12-20)18-21-7-4-3-5-8-21/h3-10,17,20H,11-16,18H2,1-2H3
InChIKeyPGQDUDULHWMHKG-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.35
Rot. Bonds7

About N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide

N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide (PubChem CID 10384292) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide
PubChem CID10384292
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(N(CCC2CCN(Cc3ccccc3)CC2)C(C)=O)c1
InChIInChI=1S/C23H30N2O2/c1-19(26)25(22-9-6-10-23(17-22)27-2)16-13-20-11-14-24(15-12-20)18-21-7-4-3-5-8-21/h3-10,17,20H,11-16,18H2,1-2H3
InChIKeyPGQDUDULHWMHKG-UHFFFAOYSA-N
XLogP4.35
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide (CID 10384292) is N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide is COc1cccc(N(CCC2CCN(Cc3ccccc3)CC2)C(C)=O)c1.
What is the InChIKey of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide?
The InChIKey is PGQDUDULHWMHKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-19(26)25(22-9-6-10-23(17-22)27-2)16-13-20-11-14-24(15-12-20)18-21-7-4-3-5-8-21/h3-10,17,20H,11-16,18H2,1-2H3.
What are the key properties of N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide?
N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide has a molecular weight of 366.51 g/mol, XLogP of 4.35, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-benzylpiperidin-4-yl)ethyl]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 10384292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).