1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide

C14H18N2O3S — CID 4782776

IUPAC1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CCC(=O)c2cccs2)CC1
InChIInChI=1S/C14H18N2O3S/c15-14(19)10-5-7-16(8-6-10)13(18)4-3-11(17)12-2-1-9-20-12/h1-2,9-10H,3-8H2,(H2,15,19)
InChIKeyGHZOTSFGLORILP-UHFFFAOYSA-N
MW294.38 g/mol
LogP1.43
Rot. Bonds5

About 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide

1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide (PubChem CID 4782776) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide
PubChem CID4782776
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)CCC(=O)c2cccs2)CC1
InChIInChI=1S/C14H18N2O3S/c15-14(19)10-5-7-16(8-6-10)13(18)4-3-11(17)12-2-1-9-20-12/h1-2,9-10H,3-8H2,(H2,15,19)
InChIKeyGHZOTSFGLORILP-UHFFFAOYSA-N
XLogP1.43
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Phenyl-[1-(thiophene-2-carbonyl)piperidin-4-yl]methanone
CID 2740735
N-cycloheptyl-4-oxo-4-thiophen-2-ylbutanamide
CID 2364189
N-[2-(4-fluorophenyl)ethyl]-4-oxo-4-thiophen-2-ylbutanamide
CID 2712705
1-(4-Oxo-4-(thiophen-2-yl)butanoyl)piperidine-3-carboxamide
CID 4878804
1-[4-(5-Methyl-2-thienyl)-1,4-dioxobutyl]-4-piperidinecarboxamide
CID 9441004
1-Butanone, 4-(1-piperidinyl)-1-(2-thienyl)-, hydrochloride
CID 3072571
1-Butanone, 4-(3-methyl-1-piperidinyl)-1-(2-thienyl)-, hydrochloride
CID 3072573
4-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-4-thiophen-2-ylbutanamide
CID 2533045
3-Cyclopentyl-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]propan-1-one
CID 717199
N-(1-ethylpiperidin-4-yl)-4-oxo-4-thiophen-2-ylbutanamide
CID 30768191
3-(1,1-Dimethylpiperidin-1-ium-2-yl)-1-thiophen-2-ylpropan-1-one
CID 44349879
3-(1-Methylpiperidin-2-yl)-1-thiophen-2-ylpropan-1-one
CID 44349944

Frequently Asked Questions

What is the IUPAC name of 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide (CID 4782776) is 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)CCC(=O)c2cccs2)CC1.
What is the InChIKey of 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide?
The InChIKey is GHZOTSFGLORILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c15-14(19)10-5-7-16(8-6-10)13(18)4-3-11(17)12-2-1-9-20-12/h1-2,9-10H,3-8H2,(H2,15,19).
What are the key properties of 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide?
1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide has a molecular weight of 294.38 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-oxo-4-thiophen-2-ylbutanoyl)piperidine-4-carboxamide is sourced from PubChem (CID 4782776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).