N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide

C11H12N4O2S — CID 71794768

IUPACN-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1nc2c(s1)COCC2
InChIInChI=1S/C11H12N4O2S/c16-10(6-15-4-1-3-12-15)14-11-13-8-2-5-17-7-9(8)18-11/h1,3-4H,2,5-7H2,(H,13,14,16)
InChIKeyYPBOHZIBXRBTFS-UHFFFAOYSA-N
MW264.31 g/mol
LogP1.05
Rot. Bonds3

About N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide

N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide (PubChem CID 71794768) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide.

Molecular Properties

Compound NameN-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide
PubChem CID71794768
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC NameN-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide
SMILESO=C(Cn1cccn1)Nc1nc2c(s1)COCC2
InChIInChI=1S/C11H12N4O2S/c16-10(6-15-4-1-3-12-15)14-11-13-8-2-5-17-7-9(8)18-11/h1,3-4H,2,5-7H2,(H,13,14,16)
InChIKeyYPBOHZIBXRBTFS-UHFFFAOYSA-N
XLogP1.05
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide?
The IUPAC name of N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide (CID 71794768) is N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide.
What is the SMILES notation for N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide?
The canonical SMILES for N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide is O=C(Cn1cccn1)Nc1nc2c(s1)COCC2.
What is the InChIKey of N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide?
The InChIKey is YPBOHZIBXRBTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c16-10(6-15-4-1-3-12-15)14-11-13-8-2-5-17-7-9(8)18-11/h1,3-4H,2,5-7H2,(H,13,14,16).
What are the key properties of N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide?
N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide has a molecular weight of 264.31 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-yl)-2-pyrazol-1-ylacetamide is sourced from PubChem (CID 71794768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).