3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

C7H9N3OS — CID 141177133

IUPAC3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESNC(=O)C1=CN=C2SCCN2C1
InChIInChI=1S/C7H9N3OS/c8-6(11)5-3-9-7-10(4-5)1-2-12-7/h3H,1-2,4H2,(H2,8,11)
InChIKeyMWPWBKVKEZGDDZ-UHFFFAOYSA-N
MW183.24 g/mol
LogP-0.23
Rot. Bonds1

About 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (PubChem CID 141177133) has the molecular formula C7H9N3OS and a molecular weight of 183.24 g/mol. Its IUPAC name is 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
PubChem CID141177133
Molecular FormulaC7H9N3OS
Molecular Weight183.24 g/mol
Exact Mass183.05
IUPAC Name3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
SMILESNC(=O)C1=CN=C2SCCN2C1
InChIInChI=1S/C7H9N3OS/c8-6(11)5-3-9-7-10(4-5)1-2-12-7/h3H,1-2,4H2,(H2,8,11)
InChIKeyMWPWBKVKEZGDDZ-UHFFFAOYSA-N
XLogP-0.23
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.24
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The IUPAC name of 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide (CID 141177133) is 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The canonical SMILES for 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is NC(=O)C1=CN=C2SCCN2C1.
What is the InChIKey of 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
The InChIKey is MWPWBKVKEZGDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3OS/c8-6(11)5-3-9-7-10(4-5)1-2-12-7/h3H,1-2,4H2,(H2,8,11).
What are the key properties of 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide?
3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide has a molecular weight of 183.24 g/mol, XLogP of -0.23, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 141177133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).