N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide

C16H24N2O3S — CID 53151078

IUPACN-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide
SMILESCOCCC1CCN(C(=O)CN(C)C(=O)c2ccsc2)CC1
InChIInChI=1S/C16H24N2O3S/c1-17(16(20)14-6-10-22-12-14)11-15(19)18-7-3-13(4-8-18)5-9-21-2/h6,10,12-13H,3-5,7-9,11H2,1-2H3
InChIKeySPEASUOGFQVDGG-UHFFFAOYSA-N
MW324.45 g/mol
LogP2.10
Rot. Bonds6

About N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide

N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide (PubChem CID 53151078) has the molecular formula C16H24N2O3S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide
PubChem CID53151078
Molecular FormulaC16H24N2O3S
Molecular Weight324.45 g/mol
Exact Mass324.15
IUPAC NameN-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide
SMILESCOCCC1CCN(C(=O)CN(C)C(=O)c2ccsc2)CC1
InChIInChI=1S/C16H24N2O3S/c1-17(16(20)14-6-10-22-12-14)11-15(19)18-7-3-13(4-8-18)5-9-21-2/h6,10,12-13H,3-5,7-9,11H2,1-2H3
InChIKeySPEASUOGFQVDGG-UHFFFAOYSA-N
XLogP2.10
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 52.10
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-methylthiophene-3-carboxamide?
The IUPAC name of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide (CID 53151078) is N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide.
What is the SMILES notation for N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide?
The canonical SMILES for N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide is COCCC1CCN(C(=O)CN(C)C(=O)c2ccsc2)CC1.
What is the InChIKey of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide?
The InChIKey is SPEASUOGFQVDGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S/c1-17(16(20)14-6-10-22-12-14)11-15(19)18-7-3-13(4-8-18)5-9-21-2/h6,10,12-13H,3-5,7-9,11H2,1-2H3.
What are the key properties of N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide?
N-[2-[4-(2-methoxyethyl)piperidin-1-yl]-2-oxoethyl]-N-methylthiophene-3-carboxamide has a molecular weight of 324.45 g/mol, XLogP of 2.10, 6 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-methylthiophene-3-carboxamide is sourced from PubChem (CID 53151078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).