N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide

C23H32N2O2 — CID 166634148

IUPACN-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide
SMILESCCC(=O)N(Cc1ccco1)CC(C)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C23H32N2O2/c1-3-23(26)25(18-22-10-7-15-27-22)17-19(2)24-13-11-21(12-14-24)16-20-8-5-4-6-9-20/h4-10,15,19,21H,3,11-14,16-18H2,1-2H3
InChIKeyDQFWUAASEYTEBG-UHFFFAOYSA-N
MW368.52 g/mol
LogP4.36
Rot. Bonds8

About N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide

N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide (PubChem CID 166634148) has the molecular formula C23H32N2O2 and a molecular weight of 368.52 g/mol. Its IUPAC name is N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide.

Molecular Properties

Compound NameN-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide
PubChem CID166634148
Molecular FormulaC23H32N2O2
Molecular Weight368.52 g/mol
Exact Mass368.25
IUPAC NameN-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide
SMILESCCC(=O)N(Cc1ccco1)CC(C)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C23H32N2O2/c1-3-23(26)25(18-22-10-7-15-27-22)17-19(2)24-13-11-21(12-14-24)16-20-8-5-4-6-9-20/h4-10,15,19,21H,3,11-14,16-18H2,1-2H3
InChIKeyDQFWUAASEYTEBG-UHFFFAOYSA-N
XLogP4.36
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.52
LogP ≤ 54.36
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)propyl]-N-(furan-2-ylmethyl)propanamide?
The IUPAC name of N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide (CID 166634148) is N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide.
What is the SMILES notation for N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide?
The canonical SMILES for N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide is CCC(=O)N(Cc1ccco1)CC(C)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide?
The InChIKey is DQFWUAASEYTEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O2/c1-3-23(26)25(18-22-10-7-15-27-22)17-19(2)24-13-11-21(12-14-24)16-20-8-5-4-6-9-20/h4-10,15,19,21H,3,11-14,16-18H2,1-2H3.
What are the key properties of N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide?
N-[2-(4-benzylpiperidin-1-yl)propyl]-N-(furan-2-ylmethyl)propanamide has a molecular weight of 368.52 g/mol, XLogP of 4.36, 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)propyl]-N-(furan-2-ylmethyl)propanamide is sourced from PubChem (CID 166634148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).