N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide

C13H18N2O2S — CID 112728802

IUPACN-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide
SMILESCC(c1cccs1)N(C)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C13H18N2O2S/c1-9(11-4-3-7-18-11)15(2)13(17)10-5-6-12(16)14-8-10/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,14,16)
InChIKeySVSKGJHKCWSJTH-UHFFFAOYSA-N
MW266.37 g/mol
LogP1.79
Rot. Bonds3

About N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide

N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide (PubChem CID 112728802) has the molecular formula C13H18N2O2S and a molecular weight of 266.37 g/mol. Its IUPAC name is N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide
PubChem CID112728802
Molecular FormulaC13H18N2O2S
Molecular Weight266.37 g/mol
Exact Mass266.11
IUPAC NameN-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide
SMILESCC(c1cccs1)N(C)C(=O)C1CCC(=O)NC1
InChIInChI=1S/C13H18N2O2S/c1-9(11-4-3-7-18-11)15(2)13(17)10-5-6-12(16)14-8-10/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,14,16)
InChIKeySVSKGJHKCWSJTH-UHFFFAOYSA-N
XLogP1.79
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide
CID 54873202
(3R)-6-oxo-N-[(1S)-1-thiophen-2-ylethyl]piperidine-3-carboxamide
CID 94154276
(2R)-N-methyl-N-(1-thiophen-2-ylethyl)piperidine-2-carboxamide
CID 104913432
1-[methyl(1-thiophen-2-ylethyl)carbamoyl]-5-oxopiperazine-2-carboxylic acid
CID 107438363
5-[(2-methyl-1-thiophen-2-ylpropyl)amino]piperidin-2-one
CID 63661199
N-methyl-N-(1-thiophen-2-ylethyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
CID 60964201
2-(azetidin-3-yl)-N-methyl-N-(1-thiophen-2-ylethyl)acetamide
CID 64610778
N-methyl-N-(4-methylsulfanylbutan-2-yl)-6-oxopiperidine-3-carboxamide
CID 115636243
N-benzyl-N-methyl-6-oxopiperidine-3-carboxamide
CID 74464257
2-amino-N-(6-oxopiperidin-3-yl)-2-thiophen-2-ylacetamide
CID 113279254
N-(2-fluorophenyl)-N-methyl-6-oxopiperidine-3-carboxamide
CID 78917930
N-methyl-2-piperidin-3-yl-N-(1-thiophen-2-ylethyl)acetamide
CID 62674552

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide?
The IUPAC name of N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide (CID 112728802) is N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide is CC(c1cccs1)N(C)C(=O)C1CCC(=O)NC1.
What is the InChIKey of N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide?
The InChIKey is SVSKGJHKCWSJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2S/c1-9(11-4-3-7-18-11)15(2)13(17)10-5-6-12(16)14-8-10/h3-4,7,9-10H,5-6,8H2,1-2H3,(H,14,16).
What are the key properties of N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide?
N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide has a molecular weight of 266.37 g/mol, XLogP of 1.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-N-(1-thiophen-2-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 112728802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).