N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide

C17H26N2O3S — CID 53151068

IUPACN-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide
SMILESCOCCC1CCN(C(=O)CN(C)C(=O)Cc2cccs2)CC1
InChIInChI=1S/C17H26N2O3S/c1-18(16(20)12-15-4-3-11-23-15)13-17(21)19-8-5-14(6-9-19)7-10-22-2/h3-4,11,14H,5-10,12-13H2,1-2H3
InChIKeyJZFNMPVBGRYMSS-UHFFFAOYSA-N
MW338.47 g/mol
LogP2.02
Rot. Bonds7

About N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide

N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide (PubChem CID 53151068) has the molecular formula C17H26N2O3S and a molecular weight of 338.47 g/mol. Its IUPAC name is N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide
PubChem CID53151068
Molecular FormulaC17H26N2O3S
Molecular Weight338.47 g/mol
Exact Mass338.17
IUPAC NameN-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide
SMILESCOCCC1CCN(C(=O)CN(C)C(=O)Cc2cccs2)CC1
InChIInChI=1S/C17H26N2O3S/c1-18(16(20)12-15-4-3-11-23-15)13-17(21)19-8-5-14(6-9-19)7-10-22-2/h3-4,11,14H,5-10,12-13H2,1-2H3
InChIKeyJZFNMPVBGRYMSS-UHFFFAOYSA-N
XLogP2.02
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.47
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide?
The IUPAC name of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide (CID 53151068) is N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide is COCCC1CCN(C(=O)CN(C)C(=O)Cc2cccs2)CC1.
What is the InChIKey of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide?
The InChIKey is JZFNMPVBGRYMSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3S/c1-18(16(20)12-15-4-3-11-23-15)13-17(21)19-8-5-14(6-9-19)7-10-22-2/h3-4,11,14H,5-10,12-13H2,1-2H3.
What are the key properties of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide?
N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide has a molecular weight of 338.47 g/mol, XLogP of 2.02, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methyl-2-thiophen-2-ylacetamide is sourced from PubChem (CID 53151068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).