N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

C16H23N3O3 — CID 78808264

IUPACN-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCN(CC(=O)NCc1ccccc1)CC(=O)N1CCOCC1
InChIInChI=1S/C16H23N3O3/c1-18(13-16(21)19-7-9-22-10-8-19)12-15(20)17-11-14-5-3-2-4-6-14/h2-6H,7-13H2,1H3,(H,17,20)
InChIKeyDKANCKITHJALQE-UHFFFAOYSA-N
MW305.38 g/mol
LogP0.09
Rot. Bonds6

About N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide

N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (PubChem CID 78808264) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
PubChem CID78808264
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC NameN-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
SMILESCN(CC(=O)NCc1ccccc1)CC(=O)N1CCOCC1
InChIInChI=1S/C16H23N3O3/c1-18(13-16(21)19-7-9-22-10-8-19)12-15(20)17-11-14-5-3-2-4-6-14/h2-6H,7-13H2,1H3,(H,17,20)
InChIKeyDKANCKITHJALQE-UHFFFAOYSA-N
XLogP0.09
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The IUPAC name of N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide (CID 78808264) is N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide.
What is the SMILES notation for N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The canonical SMILES for N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is CN(CC(=O)NCc1ccccc1)CC(=O)N1CCOCC1.
What is the InChIKey of N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
The InChIKey is DKANCKITHJALQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-18(13-16(21)19-7-9-22-10-8-19)12-15(20)17-11-14-5-3-2-4-6-14/h2-6H,7-13H2,1H3,(H,17,20).
What are the key properties of N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide?
N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide has a molecular weight of 305.38 g/mol, XLogP of 0.09, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[methyl-(2-morpholin-4-yl-2-oxoethyl)amino]acetamide is sourced from PubChem (CID 78808264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).