N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide

C17H21N3OS — CID 113015495

IUPACN-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide
SMILESCCC1CCCCN1c1ccc(NC(=O)c2cccs2)cn1
InChIInChI=1S/C17H21N3OS/c1-2-14-6-3-4-10-20(14)16-9-8-13(12-18-16)19-17(21)15-7-5-11-22-15/h5,7-9,11-12,14H,2-4,6,10H2,1H3,(H,19,21)
InChIKeyYRTWRIDOSHOUOW-UHFFFAOYSA-N
MW315.44 g/mol
LogP4.16
Rot. Bonds4

About N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide

N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide (PubChem CID 113015495) has the molecular formula C17H21N3OS and a molecular weight of 315.44 g/mol. Its IUPAC name is N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide
PubChem CID113015495
Molecular FormulaC17H21N3OS
Molecular Weight315.44 g/mol
Exact Mass315.14
IUPAC NameN-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide
SMILESCCC1CCCCN1c1ccc(NC(=O)c2cccs2)cn1
InChIInChI=1S/C17H21N3OS/c1-2-14-6-3-4-10-20(14)16-9-8-13(12-18-16)19-17(21)15-7-5-11-22-15/h5,7-9,11-12,14H,2-4,6,10H2,1H3,(H,19,21)
InChIKeyYRTWRIDOSHOUOW-UHFFFAOYSA-N
XLogP4.16
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.44
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(2-ethylpiperidin-1-yl)phenyl]thiophene-2-carboxamide
CID 112985429
N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113015544
N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]-2-(3-methylphenyl)acetamide
CID 113015543
6-(2-ethylpiperidin-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109161624
N-[6-(4-benzyl-1,4-diazepan-1-yl)-3-pyridinyl]thiophene-2-carboxamide
CID 42857505
N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]butane-1-sulfonamide
CID 113015557
5-(2-ethylpiperidin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109288653
6-(2-ethylpyrrolidin-1-yl)pyridine-3-carboxylic acid
CID 60974707
N-[3-amino-4-[(2S)-2-methylpiperidin-1-yl]phenyl]thiophene-2-carboxamide
CID 100803273
N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]-5-methylthiophene-2-sulfonamide
CID 113015578
N-[6-[3-[(4-fluorophenyl)methyl]-2-oxoimidazolidin-1-yl]-3-pyridinyl]thiophene-2-carboxamide
CID 53187583
ethyl 6-(2-ethylpiperidin-1-yl)pyridine-3-carboxylate
CID 103613521

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide?
The IUPAC name of N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide (CID 113015495) is N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide?
The canonical SMILES for N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide is CCC1CCCCN1c1ccc(NC(=O)c2cccs2)cn1.
What is the InChIKey of N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide?
The InChIKey is YRTWRIDOSHOUOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3OS/c1-2-14-6-3-4-10-20(14)16-9-8-13(12-18-16)19-17(21)15-7-5-11-22-15/h5,7-9,11-12,14H,2-4,6,10H2,1H3,(H,19,21).
What are the key properties of N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide?
N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide has a molecular weight of 315.44 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-ethylpiperidin-1-yl)-3-pyridinyl]thiophene-2-carboxamide is sourced from PubChem (CID 113015495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).