5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide

C14H22N2OS — CID 120553990

IUPAC5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide
SMILESCCc1sc(C(=O)NC2CCNCC2C)cc1C
InChIInChI=1S/C14H22N2OS/c1-4-12-9(2)7-13(18-12)14(17)16-11-5-6-15-8-10(11)3/h7,10-11,15H,4-6,8H2,1-3H3,(H,16,17)
InChIKeyIWHQYEIYSVMRAZ-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.35
Rot. Bonds3

About 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide

5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide (PubChem CID 120553990) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide
PubChem CID120553990
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide
SMILESCCc1sc(C(=O)NC2CCNCC2C)cc1C
InChIInChI=1S/C14H22N2OS/c1-4-12-9(2)7-13(18-12)14(17)16-11-5-6-15-8-10(11)3/h7,10-11,15H,4-6,8H2,1-3H3,(H,16,17)
InChIKeyIWHQYEIYSVMRAZ-UHFFFAOYSA-N
XLogP2.35
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide?
The IUPAC name of 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide (CID 120553990) is 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide.
What is the SMILES notation for 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide?
The canonical SMILES for 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide is CCc1sc(C(=O)NC2CCNCC2C)cc1C.
What is the InChIKey of 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide?
The InChIKey is IWHQYEIYSVMRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-4-12-9(2)7-13(18-12)14(17)16-11-5-6-15-8-10(11)3/h7,10-11,15H,4-6,8H2,1-3H3,(H,16,17).
What are the key properties of 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide?
5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide has a molecular weight of 266.41 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-N-(3-methylpiperidin-4-yl)thiophene-2-carboxamide is sourced from PubChem (CID 120553990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).