N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide

C22H28N2O — CID 14129733

IUPACN-benzyl-N-(1-benzylpiperidin-4-yl)propanamide
SMILESCCC(=O)N(Cc1ccccc1)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C22H28N2O/c1-2-22(25)24(18-20-11-7-4-8-12-20)21-13-15-23(16-14-21)17-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3
InChIKeyUBXNIOQMIRVNIT-UHFFFAOYSA-N
MW336.48 g/mol
LogP4.09
Rot. Bonds6

About N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide

N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide (PubChem CID 14129733) has the molecular formula C22H28N2O and a molecular weight of 336.48 g/mol. Its IUPAC name is N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide.

Molecular Properties

Compound NameN-benzyl-N-(1-benzylpiperidin-4-yl)propanamide
PubChem CID14129733
Molecular FormulaC22H28N2O
Molecular Weight336.48 g/mol
Exact Mass336.22
IUPAC NameN-benzyl-N-(1-benzylpiperidin-4-yl)propanamide
SMILESCCC(=O)N(Cc1ccccc1)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C22H28N2O/c1-2-22(25)24(18-20-11-7-4-8-12-20)21-13-15-23(16-14-21)17-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3
InChIKeyUBXNIOQMIRVNIT-UHFFFAOYSA-N
XLogP4.09
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide 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-benzyl-N-(1-benzylpiperidin-4-yl)propanamide?
The IUPAC name of N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide (CID 14129733) is N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide.
What is the SMILES notation for N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide?
The canonical SMILES for N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide is CCC(=O)N(Cc1ccccc1)C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide?
The InChIKey is UBXNIOQMIRVNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O/c1-2-22(25)24(18-20-11-7-4-8-12-20)21-13-15-23(16-14-21)17-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3.
What are the key properties of N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide?
N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide has a molecular weight of 336.48 g/mol, XLogP of 4.09, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-(1-benzylpiperidin-4-yl)propanamide is sourced from PubChem (CID 14129733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).