N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide

C16H18N2OS — CID 890979

IUPACN-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1cccs1
InChIInChI=1S/C16H18N2OS/c19-16(15-9-6-12-20-15)17-13-7-2-3-8-14(13)18-10-4-1-5-11-18/h2-3,6-9,12H,1,4-5,10-11H2,(H,17,19)
InChIKeyYSPJYULNIMGRLR-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.99
Rot. Bonds3

About N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide

N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide (PubChem CID 890979) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
PubChem CID890979
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC NameN-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1cccs1
InChIInChI=1S/C16H18N2OS/c19-16(15-9-6-12-20-15)17-13-7-2-3-8-14(13)18-10-4-1-5-11-18/h2-3,6-9,12H,1,4-5,10-11H2,(H,17,19)
InChIKeyYSPJYULNIMGRLR-UHFFFAOYSA-N
XLogP3.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide (CID 890979) is N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide is O=C(Nc1ccccc1N1CCCCC1)c1cccs1.
What is the InChIKey of N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
The InChIKey is YSPJYULNIMGRLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c19-16(15-9-6-12-20-15)17-13-7-2-3-8-14(13)18-10-4-1-5-11-18/h2-3,6-9,12H,1,4-5,10-11H2,(H,17,19).
What are the key properties of N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide?
N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide has a molecular weight of 286.40 g/mol, XLogP of 3.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide is sourced from PubChem (CID 890979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).