3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide

C14H22N2OS — CID 62844393

IUPAC3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide
SMILESCC(NC(=O)CCC1CCNCC1)c1ccsc1
InChIInChI=1S/C14H22N2OS/c1-11(13-6-9-18-10-13)16-14(17)3-2-12-4-7-15-8-5-12/h6,9-12,15H,2-5,7-8H2,1H3,(H,16,17)
InChIKeyFEQSDEGCKPHZLR-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.71
Rot. Bonds5

About 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide

3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide (PubChem CID 62844393) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide.

Molecular Properties

Compound Name3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide
PubChem CID62844393
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide
SMILESCC(NC(=O)CCC1CCNCC1)c1ccsc1
InChIInChI=1S/C14H22N2OS/c1-11(13-6-9-18-10-13)16-14(17)3-2-12-4-7-15-8-5-12/h6,9-12,15H,2-5,7-8H2,1H3,(H,16,17)
InChIKeyFEQSDEGCKPHZLR-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-piperidin-4-yl-N-[(1S)-1-pyridin-4-ylethyl]propanamide
CID 81409978
N-[1-(4-cyanophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 62212277
N-[(1S)-1-(3-fluoro-4-methylphenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 124517249
N-[(1S)-1-(2-chlorophenyl)ethyl]-3-piperidin-4-ylpropanamide
CID 81379365
(2S)-2-phenyl-2-(3-piperidin-4-ylpropanoylamino)acetic acid
CID 103870984
N-butan-2-yl-3-piperidin-4-ylpropanamide
CID 62210305
2-(tert-butylamino)-N-(1-thiophen-3-ylethyl)acetamide
CID 79257384
2-chloro-N-(1-thiophen-3-ylethyl)acetamide
CID 62842251
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-piperidin-4-ylpropanamide
CID 106388288
2-piperidin-4-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide
CID 61030445
N-[1-(4-chlorophenyl)propyl]-3-piperidin-4-ylpropanamide
CID 62211240
N-[(1R)-1-cyclopentylethyl]-3-piperidin-4-ylpropanamide
CID 81390674

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide?
The IUPAC name of 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide (CID 62844393) is 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide.
What is the SMILES notation for 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide?
The canonical SMILES for 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide is CC(NC(=O)CCC1CCNCC1)c1ccsc1.
What is the InChIKey of 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide?
The InChIKey is FEQSDEGCKPHZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-11(13-6-9-18-10-13)16-14(17)3-2-12-4-7-15-8-5-12/h6,9-12,15H,2-5,7-8H2,1H3,(H,16,17).
What are the key properties of 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide?
3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide has a molecular weight of 266.41 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-N-(1-thiophen-3-ylethyl)propanamide is sourced from PubChem (CID 62844393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).