2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide

C20H22N2O3 — CID 4876341

IUPAC2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide
SMILESCC(NC(=O)Cc1cccc2ccccc12)C(=O)N1CCC(=O)CC1
InChIInChI=1S/C20H22N2O3/c1-14(20(25)22-11-9-17(23)10-12-22)21-19(24)13-16-7-4-6-15-5-2-3-8-18(15)16/h2-8,14H,9-13H2,1H3,(H,21,24)
InChIKeyWRYSFGLEYMFXKR-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.08
Rot. Bonds4

About 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide

2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide (PubChem CID 4876341) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide
PubChem CID4876341
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide
SMILESCC(NC(=O)Cc1cccc2ccccc12)C(=O)N1CCC(=O)CC1
InChIInChI=1S/C20H22N2O3/c1-14(20(25)22-11-9-17(23)10-12-22)21-19(24)13-16-7-4-6-15-5-2-3-8-18(15)16/h2-8,14H,9-13H2,1H3,(H,21,24)
InChIKeyWRYSFGLEYMFXKR-UHFFFAOYSA-N
XLogP2.08
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide?
The IUPAC name of 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide (CID 4876341) is 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide.
What is the SMILES notation for 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide?
The canonical SMILES for 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide is CC(NC(=O)Cc1cccc2ccccc12)C(=O)N1CCC(=O)CC1.
What is the InChIKey of 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide?
The InChIKey is WRYSFGLEYMFXKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-14(20(25)22-11-9-17(23)10-12-22)21-19(24)13-16-7-4-6-15-5-2-3-8-18(15)16/h2-8,14H,9-13H2,1H3,(H,21,24).
What are the key properties of 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide?
2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide has a molecular weight of 338.41 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-N-[1-oxo-1-(4-oxopiperidin-1-yl)propan-2-yl]acetamide is sourced from PubChem (CID 4876341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).