5-bromo-N-piperidin-4-ylthiophene-3-carboxamide

C10H13BrN2OS — CID 103629654

IUPAC5-bromo-N-piperidin-4-ylthiophene-3-carboxamide
SMILESO=C(NC1CCNCC1)c1csc(Br)c1
InChIInChI=1S/C10H13BrN2OS/c11-9-5-7(6-15-9)10(14)13-8-1-3-12-4-2-8/h5-6,8,12H,1-4H2,(H,13,14)
InChIKeyMZPDRZUWQPXNJH-UHFFFAOYSA-N
MW289.20 g/mol
LogP1.99
Rot. Bonds2

About 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide

5-bromo-N-piperidin-4-ylthiophene-3-carboxamide (PubChem CID 103629654) has the molecular formula C10H13BrN2OS and a molecular weight of 289.20 g/mol. Its IUPAC name is 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-piperidin-4-ylthiophene-3-carboxamide
PubChem CID103629654
Molecular FormulaC10H13BrN2OS
Molecular Weight289.20 g/mol
Exact Mass287.99
IUPAC Name5-bromo-N-piperidin-4-ylthiophene-3-carboxamide
SMILESO=C(NC1CCNCC1)c1csc(Br)c1
InChIInChI=1S/C10H13BrN2OS/c11-9-5-7(6-15-9)10(14)13-8-1-3-12-4-2-8/h5-6,8,12H,1-4H2,(H,13,14)
InChIKeyMZPDRZUWQPXNJH-UHFFFAOYSA-N
XLogP1.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.20
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(3-methylcyclohexyl)thiophene-3-carboxamide
CID 43424605
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CID 39698292
5-bromo-N-[2-(cyclopropylamino)-2-oxoethyl]thiophene-3-carboxamide
CID 43424485
5-bromo-N-(2,4-dimethylcyclohexyl)thiophene-3-carboxamide
CID 63999980
5-bromo-N-[2-(cyclopropylamino)ethyl]thiophene-3-carboxamide
CID 103806386
5-bromo-N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]thiophene-3-carboxamide
CID 46587440
5-bromo-N-(1-piperidin-3-ylethyl)thiophene-3-carboxamide
CID 113265499
N-piperidin-4-yl-1,3-benzothiazole-6-carboxamide
CID 18337213
4-bromo-3-fluoro-N-piperidin-4-ylbenzamide;hydrochloride
CID 119386400
5-bromo-N-(1-pyrimidin-2-ylpiperidin-3-yl)thiophene-3-carboxamide
CID 60794005
N-[(4S)-azepan-4-yl]benzamide
CID 146196053
5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]thiophene-3-carboxamide
CID 105057853

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide?
The IUPAC name of 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide (CID 103629654) is 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide.
What is the SMILES notation for 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide?
The canonical SMILES for 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide is O=C(NC1CCNCC1)c1csc(Br)c1.
What is the InChIKey of 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide?
The InChIKey is MZPDRZUWQPXNJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2OS/c11-9-5-7(6-15-9)10(14)13-8-1-3-12-4-2-8/h5-6,8,12H,1-4H2,(H,13,14).
What are the key properties of 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide?
5-bromo-N-piperidin-4-ylthiophene-3-carboxamide has a molecular weight of 289.20 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-piperidin-4-ylthiophene-3-carboxamide is sourced from PubChem (CID 103629654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).