3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide

C21H33N3O2 — CID 109016578

IUPAC3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CCN1CCC(Cc2ccccc2)CC1)NCCN1CCOCC1
InChIInChI=1S/C21H33N3O2/c25-21(22-9-13-24-14-16-26-17-15-24)8-12-23-10-6-20(7-11-23)18-19-4-2-1-3-5-19/h1-5,20H,6-18H2,(H,22,25)
InChIKeyUGOMOOZHHSVIGC-UHFFFAOYSA-N
MW359.51 g/mol
LogP1.78
Rot. Bonds8

About 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide

3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide (PubChem CID 109016578) has the molecular formula C21H33N3O2 and a molecular weight of 359.51 g/mol. Its IUPAC name is 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide.

Molecular Properties

Compound Name3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide
PubChem CID109016578
Molecular FormulaC21H33N3O2
Molecular Weight359.51 g/mol
Exact Mass359.26
IUPAC Name3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide
SMILESO=C(CCN1CCC(Cc2ccccc2)CC1)NCCN1CCOCC1
InChIInChI=1S/C21H33N3O2/c25-21(22-9-13-24-14-16-26-17-15-24)8-12-23-10-6-20(7-11-23)18-19-4-2-1-3-5-19/h1-5,20H,6-18H2,(H,22,25)
InChIKeyUGOMOOZHHSVIGC-UHFFFAOYSA-N
XLogP1.78
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.51
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-morpholin-4-yl-N-(2-phenylethyl)propanamide
CID 779164
2-(4-benzylpiperidin-1-yl)ethylcarbamic acid
CID 166653471
3-(4-benzylpiperidin-1-yl)propanehydrazide
CID 63572694
N-[2-(4-benzylpiperidin-1-yl)ethyl]-3-(4-methyl-2,3-dioxoquinoxalin-1-yl)propanamide
CID 50815798
N-(4-acetamidophenyl)-3-(4-benzylpiperidin-1-yl)propanamide
CID 109032583
methyl 3-(4-benzylpiperidin-1-yl)propanoate
CID 43091070
2-(4-benzylpiperidin-1-yl)-5-(butanoylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 42751292
3-[acetyl(2-phenylethyl)amino]-N-(2-morpholin-4-ylethyl)propanamide
CID 113120745
N-[2-(4-benzylpiperidin-1-yl)ethyl]-3-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]propanamide
CID 46372473
4-benzyl-N'-methyl-N-(4-morpholin-4-ylbutyl)piperidine-1-carboximidamide;hydroiodide
CID 111152499
(2S)-2-amino-N-(2-morpholin-4-ylethyl)-4-phenylbutanamide
CID 104983793
2-(4-benzylpiperidin-1-yl)-5-[(2-chlorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 1063922

Frequently Asked Questions

What is the IUPAC name of 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The IUPAC name of 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide (CID 109016578) is 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide.
What is the SMILES notation for 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The canonical SMILES for 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide is O=C(CCN1CCC(Cc2ccccc2)CC1)NCCN1CCOCC1.
What is the InChIKey of 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide?
The InChIKey is UGOMOOZHHSVIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O2/c25-21(22-9-13-24-14-16-26-17-15-24)8-12-23-10-6-20(7-11-23)18-19-4-2-1-3-5-19/h1-5,20H,6-18H2,(H,22,25).
What are the key properties of 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide?
3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide has a molecular weight of 359.51 g/mol, XLogP of 1.78, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-benzylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)propanamide is sourced from PubChem (CID 109016578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).