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

C14H17N3O2S — CID 16933457

IUPAC2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide
SMILESCc1nc2sccn2c(=O)c1NC(=O)CC1CCCC1
InChIInChI=1S/C14H17N3O2S/c1-9-12(13(19)17-6-7-20-14(17)15-9)16-11(18)8-10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,16,18)
InChIKeyKDTHLYMGZDNZSF-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.58
Rot. Bonds3

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

2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide (PubChem CID 16933457) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide
PubChem CID16933457
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide
SMILESCc1nc2sccn2c(=O)c1NC(=O)CC1CCCC1
InChIInChI=1S/C14H17N3O2S/c1-9-12(13(19)17-6-7-20-14(17)15-9)16-11(18)8-10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,16,18)
InChIKeyKDTHLYMGZDNZSF-UHFFFAOYSA-N
XLogP2.58
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide (CID 16933457) is 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide is Cc1nc2sccn2c(=O)c1NC(=O)CC1CCCC1.
What is the InChIKey of 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide?
The InChIKey is KDTHLYMGZDNZSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-9-12(13(19)17-6-7-20-14(17)15-9)16-11(18)8-10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3,(H,16,18).
What are the key properties of 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide?
2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide has a molecular weight of 291.38 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(7-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-yl)acetamide is sourced from PubChem (CID 16933457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).