N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide

C21H33N3O2 — CID 47020366

IUPACN-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
SMILESCC1CN(C(C)C(=O)NC2CCN(Cc3ccccc3)CC2)CC(C)O1
InChIInChI=1S/C21H33N3O2/c1-16-13-24(14-17(2)26-16)18(3)21(25)22-20-9-11-23(12-10-20)15-19-7-5-4-6-8-19/h4-8,16-18,20H,9-15H2,1-3H3,(H,22,25)
InChIKeyCBIYNIISAKDDAK-UHFFFAOYSA-N
MW359.51 g/mol
LogP2.26
Rot. Bonds5

About N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide

N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide (PubChem CID 47020366) has the molecular formula C21H33N3O2 and a molecular weight of 359.51 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
PubChem CID47020366
Molecular FormulaC21H33N3O2
Molecular Weight359.51 g/mol
Exact Mass359.26
IUPAC NameN-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide
SMILESCC1CN(C(C)C(=O)NC2CCN(Cc3ccccc3)CC2)CC(C)O1
InChIInChI=1S/C21H33N3O2/c1-16-13-24(14-17(2)26-16)18(3)21(25)22-20-9-11-23(12-10-20)15-19-7-5-4-6-8-19/h4-8,16-18,20H,9-15H2,1-3H3,(H,22,25)
InChIKeyCBIYNIISAKDDAK-UHFFFAOYSA-N
XLogP2.26
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.51
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-[(1-benzylpiperidin-4-yl)amino]-1-oxopropan-2-yl]-N-methylazetidine-3-carboxamide
CID 119034158
(2S)-2-(4-benzylpiperazin-1-yl)-N-cyclopentylpropanamide
CID 2410459
(2S)-2-(4-benzylpiperazin-1-yl)-N-cyclohexylpropanamide
CID 51613241
(2S)-2-amino-N-(1-benzylpiperidin-4-yl)propanamide
CID 770488
4-amino-N-(1-benzylpiperidin-4-yl)-2-methylbutanamide
CID 80541388
2-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-N-(1-benzylpiperidin-4-yl)propanamide
CID 55525539
N-[1-[1-[(1-benzylpiperidin-4-yl)amino]-1-oxopropan-2-yl]piperidin-4-yl]-5-methylthiophene-2-carboxamide
CID 60606891
1-[1-[(1-benzylpiperidin-4-yl)amino]-1-oxopropan-2-yl]-N-propylpiperidine-3-carboxamide
CID 49440809
N-(1-benzylpiperidin-4-yl)-2-phenoxypropanamide
CID 3246759
N-(1-benzylpiperidin-4-yl)-2-[4-(1,2,4-triazol-1-yl)piperidin-1-yl]propanamide
CID 60613965
(2S)-2-amino-N-(1-benzylpyrrolidin-3-yl)propanamide
CID 66565242
(2R)-N-(1-benzylpiperidin-4-yl)-2-hydroxy-2-phenylacetamide
CID 118541642

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide (CID 47020366) is N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide is CC1CN(C(C)C(=O)NC2CCN(Cc3ccccc3)CC2)CC(C)O1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
The InChIKey is CBIYNIISAKDDAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O2/c1-16-13-24(14-17(2)26-16)18(3)21(25)22-20-9-11-23(12-10-20)15-19-7-5-4-6-8-19/h4-8,16-18,20H,9-15H2,1-3H3,(H,22,25).
What are the key properties of N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide?
N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide has a molecular weight of 359.51 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2-(2,6-dimethylmorpholin-4-yl)propanamide is sourced from PubChem (CID 47020366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).