2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide

C18H25N3O3 — CID 110109800

IUPAC2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide
SMILESCC1(C2CCN(CC(N)=O)CC2)CN(c2ccccc2)C(=O)CO1
InChIInChI=1S/C18H25N3O3/c1-18(14-7-9-20(10-8-14)11-16(19)22)13-21(17(23)12-24-18)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H2,19,22)
InChIKeyKLQQLXHXYUVELB-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.01
Rot. Bonds4

About 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide

2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide (PubChem CID 110109800) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide
PubChem CID110109800
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide
SMILESCC1(C2CCN(CC(N)=O)CC2)CN(c2ccccc2)C(=O)CO1
InChIInChI=1S/C18H25N3O3/c1-18(14-7-9-20(10-8-14)11-16(19)22)13-21(17(23)12-24-18)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H2,19,22)
InChIKeyKLQQLXHXYUVELB-UHFFFAOYSA-N
XLogP1.01
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide?
The IUPAC name of 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide (CID 110109800) is 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide?
The canonical SMILES for 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide is CC1(C2CCN(CC(N)=O)CC2)CN(c2ccccc2)C(=O)CO1.
What is the InChIKey of 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide?
The InChIKey is KLQQLXHXYUVELB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-18(14-7-9-20(10-8-14)11-16(19)22)13-21(17(23)12-24-18)15-5-3-2-4-6-15/h2-6,14H,7-13H2,1H3,(H2,19,22).
What are the key properties of 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide?
2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide has a molecular weight of 331.42 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methyl-5-oxo-4-phenylmorpholin-2-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 110109800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).