2-(1,3-thiazol-2-yl)piperidine-1-carboxamide

C9H13N3OS — CID 66584691

IUPAC2-(1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESNC(=O)N1CCCCC1c1nccs1
InChIInChI=1S/C9H13N3OS/c10-9(13)12-5-2-1-3-7(12)8-11-4-6-14-8/h4,6-7H,1-3,5H2,(H2,10,13)
InChIKeyBUDLLCZBERLSNT-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.75
Rot. Bonds1

About 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide

2-(1,3-thiazol-2-yl)piperidine-1-carboxamide (PubChem CID 66584691) has the molecular formula C9H13N3OS and a molecular weight of 211.29 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)piperidine-1-carboxamide
PubChem CID66584691
Molecular FormulaC9H13N3OS
Molecular Weight211.29 g/mol
Exact Mass211.08
IUPAC Name2-(1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESNC(=O)N1CCCCC1c1nccs1
InChIInChI=1S/C9H13N3OS/c10-9(13)12-5-2-1-3-7(12)8-11-4-6-14-8/h4,6-7H,1-3,5H2,(H2,10,13)
InChIKeyBUDLLCZBERLSNT-UHFFFAOYSA-N
XLogP1.75
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide (CID 66584691) is 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide is NC(=O)N1CCCCC1c1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is BUDLLCZBERLSNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3OS/c10-9(13)12-5-2-1-3-7(12)8-11-4-6-14-8/h4,6-7H,1-3,5H2,(H2,10,13).
What are the key properties of 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide?
2-(1,3-thiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 66584691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).