5-piperidin-1-yl-1,3-thiazole-2-carboxamide

C9H13N3OS — CID 69239597

IUPAC5-piperidin-1-yl-1,3-thiazole-2-carboxamide
SMILESNC(=O)c1ncc(N2CCCCC2)s1
InChIInChI=1S/C9H13N3OS/c10-8(13)9-11-6-7(14-9)12-4-2-1-3-5-12/h6H,1-5H2,(H2,10,13)
InChIKeyWVSWWNUCIUOICR-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.23
Rot. Bonds2

About 5-piperidin-1-yl-1,3-thiazole-2-carboxamide

5-piperidin-1-yl-1,3-thiazole-2-carboxamide (PubChem CID 69239597) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is 5-piperidin-1-yl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name5-piperidin-1-yl-1,3-thiazole-2-carboxamide
PubChem CID69239597
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC Name5-piperidin-1-yl-1,3-thiazole-2-carboxamide
SMILESNC(=O)c1ncc(N2CCCCC2)s1
InChIInChI=1S/C9H13N3OS/c10-8(13)9-11-6-7(14-9)12-4-2-1-3-5-12/h6H,1-5H2,(H2,10,13)
InChIKeyWVSWWNUCIUOICR-UHFFFAOYSA-N
XLogP1.23
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-piperidin-1-yl-1,3-thiazole-2-carboxamide?
The IUPAC name of 5-piperidin-1-yl-1,3-thiazole-2-carboxamide (CID 69239597) is 5-piperidin-1-yl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 5-piperidin-1-yl-1,3-thiazole-2-carboxamide?
The canonical SMILES for 5-piperidin-1-yl-1,3-thiazole-2-carboxamide is NC(=O)c1ncc(N2CCCCC2)s1.
What is the InChIKey of 5-piperidin-1-yl-1,3-thiazole-2-carboxamide?
The InChIKey is WVSWWNUCIUOICR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c10-8(13)9-11-6-7(14-9)12-4-2-1-3-5-12/h6H,1-5H2,(H2,10,13).
What are the key properties of 5-piperidin-1-yl-1,3-thiazole-2-carboxamide?
5-piperidin-1-yl-1,3-thiazole-2-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-1-yl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 69239597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).