5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C10H7N5O2S — CID 43429645

IUPAC5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cnc2sccn2c1=O
InChIInChI=1S/C10H7N5O2S/c16-8(14-6-3-12-13-4-6)7-5-11-10-15(9(7)17)1-2-18-10/h1-5H,(H,12,13)(H,14,16)
InChIKeyAZCXYLZZFBBRSU-UHFFFAOYSA-N
MW261.27 g/mol
LogP0.73
Rot. Bonds2

About 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 43429645) has the molecular formula C10H7N5O2S and a molecular weight of 261.27 g/mol. Its IUPAC name is 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID43429645
Molecular FormulaC10H7N5O2S
Molecular Weight261.27 g/mol
Exact Mass261.03
IUPAC Name5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cnc2sccn2c1=O
InChIInChI=1S/C10H7N5O2S/c16-8(14-6-3-12-13-4-6)7-5-11-10-15(9(7)17)1-2-18-10/h1-5H,(H,12,13)(H,14,16)
InChIKeyAZCXYLZZFBBRSU-UHFFFAOYSA-N
XLogP0.73
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.27
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 43429645) is 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is O=C(Nc1cn[nH]c1)c1cnc2sccn2c1=O.
What is the InChIKey of 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is AZCXYLZZFBBRSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N5O2S/c16-8(14-6-3-12-13-4-6)7-5-11-10-15(9(7)17)1-2-18-10/h1-5H,(H,12,13)(H,14,16).
What are the key properties of 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 261.27 g/mol, XLogP of 0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-(1H-pyrazol-4-yl)-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 43429645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).