4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide

C20H32N2OS — CID 24981574

IUPAC4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
SMILESCCc1cc(C(=O)NCC2(N3CCCCC3)CCCCC2)sc1C
InChIInChI=1S/C20H32N2OS/c1-3-17-14-18(24-16(17)2)19(23)21-15-20(10-6-4-7-11-20)22-12-8-5-9-13-22/h14H,3-13,15H2,1-2H3,(H,21,23)
InChIKeyYLXZNXWPSYOLDK-UHFFFAOYSA-N
MW348.56 g/mol
LogP4.54
Rot. Bonds5

About 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide

4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide (PubChem CID 24981574) has the molecular formula C20H32N2OS and a molecular weight of 348.56 g/mol. Its IUPAC name is 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
PubChem CID24981574
Molecular FormulaC20H32N2OS
Molecular Weight348.56 g/mol
Exact Mass348.22
IUPAC Name4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
SMILESCCc1cc(C(=O)NCC2(N3CCCCC3)CCCCC2)sc1C
InChIInChI=1S/C20H32N2OS/c1-3-17-14-18(24-16(17)2)19(23)21-15-20(10-6-4-7-11-20)22-12-8-5-9-13-22/h14H,3-13,15H2,1-2H3,(H,21,23)
InChIKeyYLXZNXWPSYOLDK-UHFFFAOYSA-N
XLogP4.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.56
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
The IUPAC name of 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide (CID 24981574) is 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
The canonical SMILES for 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide is CCc1cc(C(=O)NCC2(N3CCCCC3)CCCCC2)sc1C.
What is the InChIKey of 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
The InChIKey is YLXZNXWPSYOLDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N2OS/c1-3-17-14-18(24-16(17)2)19(23)21-15-20(10-6-4-7-11-20)22-12-8-5-9-13-22/h14H,3-13,15H2,1-2H3,(H,21,23).
What are the key properties of 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide has a molecular weight of 348.56 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 24981574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).