N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

C19H27N3O3 — CID 126454821

IUPACN-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCON1CCC(N(C)C(=O)Cc2cccc(N3CCCC3=O)c2)CC1
InChIInChI=1S/C19H27N3O3/c1-20(16-8-11-21(25-2)12-9-16)19(24)14-15-5-3-6-17(13-15)22-10-4-7-18(22)23/h3,5-6,13,16H,4,7-12,14H2,1-2H3
InChIKeyWRUPQNDWNLYMPD-UHFFFAOYSA-N
MW345.44 g/mol
LogP1.84
Rot. Bonds5

About N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide

N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (PubChem CID 126454821) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
PubChem CID126454821
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC NameN-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
SMILESCON1CCC(N(C)C(=O)Cc2cccc(N3CCCC3=O)c2)CC1
InChIInChI=1S/C19H27N3O3/c1-20(16-8-11-21(25-2)12-9-16)19(24)14-15-5-3-6-17(13-15)22-10-4-7-18(22)23/h3,5-6,13,16H,4,7-12,14H2,1-2H3
InChIKeyWRUPQNDWNLYMPD-UHFFFAOYSA-N
XLogP1.84
TPSA53.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The IUPAC name of N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide (CID 126454821) is N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide.
What is the SMILES notation for N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The canonical SMILES for N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is CON1CCC(N(C)C(=O)Cc2cccc(N3CCCC3=O)c2)CC1.
What is the InChIKey of N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
The InChIKey is WRUPQNDWNLYMPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-20(16-8-11-21(25-2)12-9-16)19(24)14-15-5-3-6-17(13-15)22-10-4-7-18(22)23/h3,5-6,13,16H,4,7-12,14H2,1-2H3.
What are the key properties of N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide?
N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide has a molecular weight of 345.44 g/mol, XLogP of 1.84, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypiperidin-4-yl)-N-methyl-2-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide is sourced from PubChem (CID 126454821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).