2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide

C8H14N4OS — CID 142626699

IUPAC2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide
SMILESNC(=O)C1(N2CCNCC2)NC=CS1
InChIInChI=1S/C8H14N4OS/c9-7(13)8(11-3-6-14-8)12-4-1-10-2-5-12/h3,6,10-11H,1-2,4-5H2,(H2,9,13)
InChIKeySGTPPQDQXMDLRT-UHFFFAOYSA-N
MW214.29 g/mol
LogP-1.16
Rot. Bonds2

About 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide

2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide (PubChem CID 142626699) has the molecular formula C8H14N4OS and a molecular weight of 214.29 g/mol. Its IUPAC name is 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide
PubChem CID142626699
Molecular FormulaC8H14N4OS
Molecular Weight214.29 g/mol
Exact Mass214.09
IUPAC Name2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide
SMILESNC(=O)C1(N2CCNCC2)NC=CS1
InChIInChI=1S/C8H14N4OS/c9-7(13)8(11-3-6-14-8)12-4-1-10-2-5-12/h3,6,10-11H,1-2,4-5H2,(H2,9,13)
InChIKeySGTPPQDQXMDLRT-UHFFFAOYSA-N
XLogP-1.16
TPSA70.39 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 5-1.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide?
The IUPAC name of 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide (CID 142626699) is 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide?
The canonical SMILES for 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide is NC(=O)C1(N2CCNCC2)NC=CS1.
What is the InChIKey of 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide?
The InChIKey is SGTPPQDQXMDLRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4OS/c9-7(13)8(11-3-6-14-8)12-4-1-10-2-5-12/h3,6,10-11H,1-2,4-5H2,(H2,9,13).
What are the key properties of 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide?
2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide has a molecular weight of 214.29 g/mol, XLogP of -1.16, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-3H-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 142626699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).