N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide

C15H21N3O3 — CID 17451981

IUPACN-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide
SMILESCC1CN(CC(=O)NC(=O)NCc2ccccc2)CCO1
InChIInChI=1S/C15H21N3O3/c1-12-10-18(7-8-21-12)11-14(19)17-15(20)16-9-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,16,17,19,20)
InChIKeyGFLHQEBMYDQVNT-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.73
Rot. Bonds4

About N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide

N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide (PubChem CID 17451981) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide.

Molecular Properties

Compound NameN-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide
PubChem CID17451981
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide
SMILESCC1CN(CC(=O)NC(=O)NCc2ccccc2)CCO1
InChIInChI=1S/C15H21N3O3/c1-12-10-18(7-8-21-12)11-14(19)17-15(20)16-9-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,16,17,19,20)
InChIKeyGFLHQEBMYDQVNT-UHFFFAOYSA-N
XLogP0.73
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide?
The IUPAC name of N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide (CID 17451981) is N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide.
What is the SMILES notation for N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide?
The canonical SMILES for N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide is CC1CN(CC(=O)NC(=O)NCc2ccccc2)CCO1.
What is the InChIKey of N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide?
The InChIKey is GFLHQEBMYDQVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-12-10-18(7-8-21-12)11-14(19)17-15(20)16-9-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,16,17,19,20).
What are the key properties of N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide?
N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 0.73, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzylcarbamoyl)-2-(2-methylmorpholin-4-yl)acetamide is sourced from PubChem (CID 17451981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).