N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide

C14H22N2O2S — CID 16895546

IUPACN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide
SMILESCOCCN1CCC(CNC(=O)c2cccs2)CC1
InChIInChI=1S/C14H22N2O2S/c1-18-9-8-16-6-4-12(5-7-16)11-15-14(17)13-3-2-10-19-13/h2-3,10,12H,4-9,11H2,1H3,(H,15,17)
InChIKeyOATUJLZAJSDOLM-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.84
Rot. Bonds6

About N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide

N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide (PubChem CID 16895546) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide
PubChem CID16895546
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide
SMILESCOCCN1CCC(CNC(=O)c2cccs2)CC1
InChIInChI=1S/C14H22N2O2S/c1-18-9-8-16-6-4-12(5-7-16)11-15-14(17)13-3-2-10-19-13/h2-3,10,12H,4-9,11H2,1H3,(H,15,17)
InChIKeyOATUJLZAJSDOLM-UHFFFAOYSA-N
XLogP1.84
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide?
The IUPAC name of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide (CID 16895546) is N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide?
The canonical SMILES for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide is COCCN1CCC(CNC(=O)c2cccs2)CC1.
What is the InChIKey of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide?
The InChIKey is OATUJLZAJSDOLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-18-9-8-16-6-4-12(5-7-16)11-15-14(17)13-3-2-10-19-13/h2-3,10,12H,4-9,11H2,1H3,(H,15,17).
What are the key properties of N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide?
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide has a molecular weight of 282.41 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]thiophene-2-carboxamide is sourced from PubChem (CID 16895546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).