N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide

C11H15BrN2OS — CID 115160642

IUPACN-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide
SMILESO=C(CC1CCNCC1)Nc1cc(Br)cs1
InChIInChI=1S/C11H15BrN2OS/c12-9-6-11(16-7-9)14-10(15)5-8-1-3-13-4-2-8/h6-8,13H,1-5H2,(H,14,15)
InChIKeyPQDOURCENLOFFQ-UHFFFAOYSA-N
MW303.23 g/mol
LogP2.84
Rot. Bonds3

About N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide

N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide (PubChem CID 115160642) has the molecular formula C11H15BrN2OS and a molecular weight of 303.23 g/mol. Its IUPAC name is N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide
PubChem CID115160642
Molecular FormulaC11H15BrN2OS
Molecular Weight303.23 g/mol
Exact Mass302.01
IUPAC NameN-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide
SMILESO=C(CC1CCNCC1)Nc1cc(Br)cs1
InChIInChI=1S/C11H15BrN2OS/c12-9-6-11(16-7-9)14-10(15)5-8-1-3-13-4-2-8/h6-8,13H,1-5H2,(H,14,15)
InChIKeyPQDOURCENLOFFQ-UHFFFAOYSA-N
XLogP2.84
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.23
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-bromo-2-methylphenyl)-2-piperidin-4-ylacetamide
CID 54910115
N-(4-bromo-2-fluorophenyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119673443
N-(4-bromo-2,5-difluorophenyl)-2-piperidin-4-ylacetamide
CID 107611674
N-[(1R)-1-(4-bromophenyl)ethyl]-2-piperidin-4-ylacetamide
CID 81359105
N-(3-bromo-2-hydroxyphenyl)-2-piperidin-4-ylacetamide
CID 81494966
N-(2-bromo-5-methylphenyl)-2-piperidin-4-ylacetamide
CID 82757301
N-[(4-bromothiophen-2-yl)methyl]-N-methyl-2-piperidin-4-ylacetamide;hydrochloride
CID 119731612
3,5-dichloro-4-[(2-piperidin-4-ylacetyl)amino]benzoic acid
CID 82812101
N-(4-bromothiophen-2-yl)-4-hydroxybutanamide
CID 115162800
N-(3,5-dimethoxyphenyl)-2-piperidin-4-ylacetamide
CID 24703765
N-[1-(3-bromophenyl)ethyl]-2-piperidin-4-ylacetamide;hydrochloride
CID 119716420
N-(2,4-difluorophenyl)-2-piperidin-4-ylacetamide
CID 24692446

Frequently Asked Questions

What is the IUPAC name of N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide?
The IUPAC name of N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide (CID 115160642) is N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide?
The canonical SMILES for N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide is O=C(CC1CCNCC1)Nc1cc(Br)cs1.
What is the InChIKey of N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide?
The InChIKey is PQDOURCENLOFFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2OS/c12-9-6-11(16-7-9)14-10(15)5-8-1-3-13-4-2-8/h6-8,13H,1-5H2,(H,14,15).
What are the key properties of N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide?
N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide has a molecular weight of 303.23 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromothiophen-2-yl)-2-piperidin-4-ylacetamide is sourced from PubChem (CID 115160642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).