N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide

C13H15N3OS — CID 24705272

IUPACN-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2s1)C1CCNCC1
InChIInChI=1S/C13H15N3OS/c17-12(9-5-7-14-8-6-9)16-13-15-10-3-1-2-4-11(10)18-13/h1-4,9,14H,5-8H2,(H,15,16,17)
InChIKeyGRELSJXPLCZGKC-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.23
Rot. Bonds2

About N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide

N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide (PubChem CID 24705272) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide
PubChem CID24705272
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC NameN-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide
SMILESO=C(Nc1nc2ccccc2s1)C1CCNCC1
InChIInChI=1S/C13H15N3OS/c17-12(9-5-7-14-8-6-9)16-13-15-10-3-1-2-4-11(10)18-13/h1-4,9,14H,5-8H2,(H,15,16,17)
InChIKeyGRELSJXPLCZGKC-UHFFFAOYSA-N
XLogP2.23
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N,4-N-bis(1,3-benzothiazol-2-yl)cyclohexane-1,4-dicarboxamide
CID 171722456
N-(1,3-benzothiazol-2-yl)cyclopentanecarboxamide
CID 835551
N-[2-(1,3-benzothiazol-2-yl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119270096
N-(1,3-benzothiazol-2-yl)-1-(cyclopropanecarbonyl)piperidine-4-carboxamide
CID 26251597
5-(1,3-benzothiazol-2-ylcarbamoyl)oxolane-2-carboxylic acid
CID 102687647
N-(4-methoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide;hydrochloride
CID 119271366
N,N'-bis(1,3-benzothiazol-2-yl)oxamide
CID 591706
N-(1,3-benzothiazol-2-yl)-2-oxo-2-piperazin-1-ylacetamide
CID 43327538
1-(1,3-benzothiazol-2-yl)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide
CID 90609369
2-(1,3-benzothiazol-2-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 4153811
(3R,5S)-N-(1,3-benzothiazol-2-yl)-3,5-dimethyladamantane-1-carboxamide
CID 971289
N-(1,3-benzothiazol-2-yl)-1-(6-methylpyridazin-3-yl)piperidine-4-carboxamide
CID 121118820

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide (CID 24705272) is N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide is O=C(Nc1nc2ccccc2s1)C1CCNCC1.
What is the InChIKey of N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide?
The InChIKey is GRELSJXPLCZGKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c17-12(9-5-7-14-8-6-9)16-13-15-10-3-1-2-4-11(10)18-13/h1-4,9,14H,5-8H2,(H,15,16,17).
What are the key properties of N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide?
N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide has a molecular weight of 261.35 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzothiazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 24705272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).