N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide

C13H15N3O2S — CID 16933450

IUPACN-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide
SMILESCc1nc2sccn2c(=O)c1NC(=O)C1CCCC1
InChIInChI=1S/C13H15N3O2S/c1-8-10(15-11(17)9-4-2-3-5-9)12(18)16-6-7-19-13(16)14-8/h6-7,9H,2-5H2,1H3,(H,15,17)
InChIKeyBLDLDCJGJQJMDF-UHFFFAOYSA-N
MW277.35 g/mol
LogP2.19
Rot. Bonds2

About N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide

N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide (PubChem CID 16933450) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide
PubChem CID16933450
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC NameN-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide
SMILESCc1nc2sccn2c(=O)c1NC(=O)C1CCCC1
InChIInChI=1S/C13H15N3O2S/c1-8-10(15-11(17)9-4-2-3-5-9)12(18)16-6-7-19-13(16)14-8/h6-7,9H,2-5H2,1H3,(H,15,17)
InChIKeyBLDLDCJGJQJMDF-UHFFFAOYSA-N
XLogP2.19
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide?
The IUPAC name of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide (CID 16933450) is N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide is Cc1nc2sccn2c(=O)c1NC(=O)C1CCCC1.
What is the InChIKey of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide?
The InChIKey is BLDLDCJGJQJMDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-8-10(15-11(17)9-4-2-3-5-9)12(18)16-6-7-19-13(16)14-8/h6-7,9H,2-5H2,1H3,(H,15,17).
What are the key properties of N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide?
N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide has a molecular weight of 277.35 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)cyclopentanecarboxamide is sourced from PubChem (CID 16933450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).