N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide

C18H26N2O3 — CID 72865270

IUPACN-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESCOCCN(Cc1ccc(C)cc1)C(=O)CN1CCCCC1=O
InChIInChI=1S/C18H26N2O3/c1-15-6-8-16(9-7-15)13-20(11-12-23-2)18(22)14-19-10-4-3-5-17(19)21/h6-9H,3-5,10-14H2,1-2H3
InChIKeyGDOSZHRIRSSKNV-UHFFFAOYSA-N
MW318.42 g/mol
LogP1.98
Rot. Bonds7

About N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide

N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide (PubChem CID 72865270) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
PubChem CID72865270
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC NameN-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide
SMILESCOCCN(Cc1ccc(C)cc1)C(=O)CN1CCCCC1=O
InChIInChI=1S/C18H26N2O3/c1-15-6-8-16(9-7-15)13-20(11-12-23-2)18(22)14-19-10-4-3-5-17(19)21/h6-9H,3-5,10-14H2,1-2H3
InChIKeyGDOSZHRIRSSKNV-UHFFFAOYSA-N
XLogP1.98
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The IUPAC name of N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide (CID 72865270) is N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The canonical SMILES for N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide is COCCN(Cc1ccc(C)cc1)C(=O)CN1CCCCC1=O.
What is the InChIKey of N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
The InChIKey is GDOSZHRIRSSKNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-15-6-8-16(9-7-15)13-20(11-12-23-2)18(22)14-19-10-4-3-5-17(19)21/h6-9H,3-5,10-14H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide?
N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide has a molecular weight of 318.42 g/mol, XLogP of 1.98, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[(4-methylphenyl)methyl]-2-(2-oxopiperidin-1-yl)acetamide is sourced from PubChem (CID 72865270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).