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

C24H32N2O2 — CID 156782565

IUPACN-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide
SMILESCCC(=O)N(CCN1CCC(Cc2ccccc2)CC1)c1ccc(OC)cc1
InChIInChI=1S/C24H32N2O2/c1-3-24(27)26(22-9-11-23(28-2)12-10-22)18-17-25-15-13-21(14-16-25)19-20-7-5-4-6-8-20/h4-12,21H,3,13-19H2,1-2H3
InChIKeyVFEPFPPVBQXPEK-UHFFFAOYSA-N
MW380.53 g/mol
LogP4.39
Rot. Bonds8

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

N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide (PubChem CID 156782565) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide
PubChem CID156782565
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC NameN-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide
SMILESCCC(=O)N(CCN1CCC(Cc2ccccc2)CC1)c1ccc(OC)cc1
InChIInChI=1S/C24H32N2O2/c1-3-24(27)26(22-9-11-23(28-2)12-10-22)18-17-25-15-13-21(14-16-25)19-20-7-5-4-6-8-20/h4-12,21H,3,13-19H2,1-2H3
InChIKeyVFEPFPPVBQXPEK-UHFFFAOYSA-N
XLogP4.39
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide?
The IUPAC name of N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide (CID 156782565) is N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide is CCC(=O)N(CCN1CCC(Cc2ccccc2)CC1)c1ccc(OC)cc1.
What is the InChIKey of N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide?
The InChIKey is VFEPFPPVBQXPEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-3-24(27)26(22-9-11-23(28-2)12-10-22)18-17-25-15-13-21(14-16-25)19-20-7-5-4-6-8-20/h4-12,21H,3,13-19H2,1-2H3.
What are the key properties of N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide?
N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide has a molecular weight of 380.53 g/mol, XLogP of 4.39, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-benzylpiperidin-1-yl)ethyl]-N-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 156782565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).