N-piperidin-4-yl-1,3-thiazole-4-carboxamide

C9H13N3OS — CID 23113297

IUPACN-piperidin-4-yl-1,3-thiazole-4-carboxamide
SMILESO=C(NC1CCNCC1)c1cscn1
InChIInChI=1S/C9H13N3OS/c13-9(8-5-14-6-11-8)12-7-1-3-10-4-2-7/h5-7,10H,1-4H2,(H,12,13)
InChIKeyICTORDUZIFENJZ-UHFFFAOYSA-N
MW211.29 g/mol
LogP0.62
Rot. Bonds2

About N-piperidin-4-yl-1,3-thiazole-4-carboxamide

N-piperidin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 23113297) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is N-piperidin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-piperidin-4-yl-1,3-thiazole-4-carboxamide
PubChem CID23113297
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC NameN-piperidin-4-yl-1,3-thiazole-4-carboxamide
SMILESO=C(NC1CCNCC1)c1cscn1
InChIInChI=1S/C9H13N3OS/c13-9(8-5-14-6-11-8)12-7-1-3-10-4-2-7/h5-7,10H,1-4H2,(H,12,13)
InChIKeyICTORDUZIFENJZ-UHFFFAOYSA-N
XLogP0.62
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-carbamoylcyclohexyl)-1,3-thiazole-4-carboxamide
CID 63049397
N-(oxolan-3-yl)-1,3-thiazole-4-carboxamide
CID 80713032
N-(1,4-dioxaspiro[4.5]decan-8-yl)-1,3-thiazole-4-carboxamide
CID 78926012
N-(3,3-dimethylcyclopentyl)-1,3-thiazole-4-carboxamide
CID 115880619
pyrrolidin-3-yl(1,3-thiazol-4-yl)methanone
CID 130670441
5-bromo-N-piperidin-4-ylpyrazine-2-carboxamide
CID 112531060
N-(1-cyclopentylpyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
CID 110462193
N-(4-methoxypyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
CID 76982257
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1,3-thiazole-4-carboxamide
CID 104971777
6-(piperidin-4-ylcarbamoyl)pyridine-2-carboxylic acid
CID 61403349
4-tert-butyl-N-piperidin-4-yl-1,3-thiazole-5-carboxamide
CID 119387512
N-(1-cyclobutylethyl)-1,3-thiazole-4-carboxamide
CID 115769139

Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-piperidin-4-yl-1,3-thiazole-4-carboxamide (CID 23113297) is N-piperidin-4-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-piperidin-4-yl-1,3-thiazole-4-carboxamide is O=C(NC1CCNCC1)c1cscn1.
What is the InChIKey of N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
The InChIKey is ICTORDUZIFENJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c13-9(8-5-14-6-11-8)12-7-1-3-10-4-2-7/h5-7,10H,1-4H2,(H,12,13).
What are the key properties of N-piperidin-4-yl-1,3-thiazole-4-carboxamide?
N-piperidin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 23113297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).