N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide

C16H20N2O2S — CID 4880331

IUPACN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCCCC1)c1cccs1
InChIInChI=1S/C16H20N2O2S/c19-16(15-7-5-11-21-15)17-12-13(14-6-4-10-20-14)18-8-2-1-3-9-18/h4-7,10-11,13H,1-3,8-9,12H2,(H,17,19)
InChIKeyZMBYQWZKUSIBDT-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.30
Rot. Bonds5

About N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide (PubChem CID 4880331) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide
PubChem CID4880331
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC NameN-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide
SMILESO=C(NCC(c1ccco1)N1CCCCC1)c1cccs1
InChIInChI=1S/C16H20N2O2S/c19-16(15-7-5-11-21-15)17-12-13(14-6-4-10-20-14)18-8-2-1-3-9-18/h4-7,10-11,13H,1-3,8-9,12H2,(H,17,19)
InChIKeyZMBYQWZKUSIBDT-UHFFFAOYSA-N
XLogP3.30
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(furan-2-ylmethyl)thiophene-2-carboxamide
CID 573774
N-(furan-2-ylmethyl)-3-[3-(furan-2-ylmethylamino)-3-oxopropyl]sulfanylpropanamide
CID 557197
N-[2-(cyclohexylamino)-2-oxo-1-thiophen-2-ylethyl]-N-(2-phenylethyl)furan-2-carboxamide
CID 3191424
N-[1-{[(2-furylmethyl)amino]carbonyl}-2-(2-thienyl)vinyl]benzamide
CID 2177140
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-nitrothiophene-2-carboxamide
CID 4839353
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]thiophene-2-carboxamide
CID 4884562
Furan-2-yl-[4-(3-methylthiophene-2-carbonyl)piperazin-1-yl]methanone
CID 25163808
3-hydroxy-5-(5-methyl-2-furyl)-1-[2-(4-morpholinyl)ethyl]-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
CID 2909894
N-Cyclopentyl-2-[furan-2-ylmethyl-(2-thiophen-2-yl-acetyl)-amino]-2-thiophen-3-yl-acetamide
CID 648156
N-Furan-2-ylmethyl-2-[phenyl-(2-thiophen-2-yl-acetyl)-amino]-2-thiophen-2-yl-acetamide
CID 649429
2-Benzenesulfonylamino-N-{[(furan-2-ylmethyl)-carbamoyl]-methyl}-N-thiophen-2-ylmethyl-acetamide
CID 651765
Furan-2-carboxylic acid (cyclohexylcarbamoyl-thiophen-2-yl-methyl)-thiophen-2-ylmethyl-amide
CID 654363

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide (CID 4880331) is N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide is O=C(NCC(c1ccco1)N1CCCCC1)c1cccs1.
What is the InChIKey of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
The InChIKey is ZMBYQWZKUSIBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c19-16(15-7-5-11-21-15)17-12-13(14-6-4-10-20-14)18-8-2-1-3-9-18/h4-7,10-11,13H,1-3,8-9,12H2,(H,17,19).
What are the key properties of N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide?
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide has a molecular weight of 304.42 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]thiophene-2-carboxamide is sourced from PubChem (CID 4880331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).