2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide

C20H25N3O2 — CID 71991420

IUPAC2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide
SMILESCc1ccc(CNC(=O)CC2CN(Cc3ccccc3)CCO2)cn1
InChIInChI=1S/C20H25N3O2/c1-16-7-8-18(12-21-16)13-22-20(24)11-19-15-23(9-10-25-19)14-17-5-3-2-4-6-17/h2-8,12,19H,9-11,13-15H2,1H3,(H,22,24)
InChIKeyCPXFUXAHKXNGJZ-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.30
Rot. Bonds6

About 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide

2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide (PubChem CID 71991420) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide
PubChem CID71991420
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide
SMILESCc1ccc(CNC(=O)CC2CN(Cc3ccccc3)CCO2)cn1
InChIInChI=1S/C20H25N3O2/c1-16-7-8-18(12-21-16)13-22-20(24)11-19-15-23(9-10-25-19)14-17-5-3-2-4-6-17/h2-8,12,19H,9-11,13-15H2,1H3,(H,22,24)
InChIKeyCPXFUXAHKXNGJZ-UHFFFAOYSA-N
XLogP2.30
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[[2-[(2R)-4-benzylmorpholin-2-yl]acetyl]amino]methyl]benzoic acid
CID 124703826
N-(2-aminoethyl)-2-(4-benzylmorpholin-2-yl)acetamide
CID 119383303
N-(3-amino-2-methylpropyl)-2-(4-benzylmorpholin-2-yl)acetamide
CID 119995447
2-(4-benzylmorpholin-2-yl)-N-(imidazo[1,2-a]pyrazin-3-ylmethyl)acetamide
CID 90651071
2-(4-benzylmorpholin-2-yl)-N-(3-hydroxybutyl)acetamide
CID 111539052
2-(4-benzylmorpholin-2-yl)-N-[2-(cycloheptylamino)ethyl]acetamide
CID 119620021
2-(4-benzylmorpholin-2-yl)-N-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-ylmethyl)acetamide
CID 118769797
2-(4-benzylmorpholin-2-yl)-N-[(2-oxo-1H-quinolin-4-yl)methyl]acetamide
CID 136512300
2-(4-benzylmorpholin-2-yl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111540025
(4-benzylmorpholin-2-yl)methylcarbamic acid
CID 21104645
2-[(2S)-4-benzylmorpholin-2-yl]-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 124588180
2-[(2R)-4-benzylmorpholin-2-yl]-N-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl]acetamide
CID 96542097

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide (CID 71991420) is 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide is Cc1ccc(CNC(=O)CC2CN(Cc3ccccc3)CCO2)cn1.
What is the InChIKey of 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide?
The InChIKey is CPXFUXAHKXNGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-16-7-8-18(12-21-16)13-22-20(24)11-19-15-23(9-10-25-19)14-17-5-3-2-4-6-17/h2-8,12,19H,9-11,13-15H2,1H3,(H,22,24).
What are the key properties of 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide?
2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide has a molecular weight of 339.44 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 71991420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).