5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide

C12H17ClN2OS — CID 25237516

IUPAC5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCCN1CCCCC1)c1ccc(Cl)s1
InChIInChI=1S/C12H17ClN2OS/c13-11-5-4-10(17-11)12(16)14-6-9-15-7-2-1-3-8-15/h4-5H,1-3,6-9H2,(H,14,16)
InChIKeyGQMAFKJGCTXMFD-UHFFFAOYSA-N
MW272.80 g/mol
LogP2.62
Rot. Bonds4

About 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide

5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide (PubChem CID 25237516) has the molecular formula C12H17ClN2OS and a molecular weight of 272.80 g/mol. Its IUPAC name is 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide
PubChem CID25237516
Molecular FormulaC12H17ClN2OS
Molecular Weight272.80 g/mol
Exact Mass272.08
IUPAC Name5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCCN1CCCCC1)c1ccc(Cl)s1
InChIInChI=1S/C12H17ClN2OS/c13-11-5-4-10(17-11)12(16)14-6-9-15-7-2-1-3-8-15/h4-5H,1-3,6-9H2,(H,14,16)
InChIKeyGQMAFKJGCTXMFD-UHFFFAOYSA-N
XLogP2.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.80
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide
CID 55029116
5-chloro-N-[2-(cycloheptylamino)ethyl]thiophene-2-carboxamide;hydrochloride
CID 119621242
5-chloro-N-[3-(4-phenylpiperazin-1-yl)propyl]thiophene-2-carboxamide
CID 38449040
5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
CID 25161511
5-chloro-N-[2-[4-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl]thiophene-2-carboxamide
CID 44898880
N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide;hydrochloride
CID 2952427
2-chloro-N-(2-pyrrolidin-1-ylethyl)benzamide;hydrochloride
CID 2941366
2,3-dichloro-N-(2-piperidin-1-ylethyl)benzamide
CID 17173706
5-chloro-N-(3-pyrrol-1-ylpropyl)thiophene-2-carboxamide
CID 90500681
3,6-dichloro-N-(2-pyrrolidin-1-ylethyl)pyridine-2-carboxamide
CID 1397872
5-bromo-4-methyl-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide
CID 79965307
5-chloro-N-(2-imidazol-1-ylethyl)thiophene-2-carboxamide
CID 47143117

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide (CID 25237516) is 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide is O=C(NCCN1CCCCC1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide?
The InChIKey is GQMAFKJGCTXMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2OS/c13-11-5-4-10(17-11)12(16)14-6-9-15-7-2-1-3-8-15/h4-5H,1-3,6-9H2,(H,14,16).
What are the key properties of 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide?
5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide has a molecular weight of 272.80 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide is sourced from PubChem (CID 25237516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).