5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide

C6H9N3OS — CID 83695506

IUPAC5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide
SMILESCN(C)C(=O)c1ncc(N)s1
InChIInChI=1S/C6H9N3OS/c1-9(2)6(10)5-8-3-4(7)11-5/h3H,7H2,1-2H3
InChIKeyPFEZHGQTVQPARQ-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.43
Rot. Bonds1

About 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide

5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide (PubChem CID 83695506) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound Name5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide
PubChem CID83695506
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC Name5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide
SMILESCN(C)C(=O)c1ncc(N)s1
InChIInChI=1S/C6H9N3OS/c1-9(2)6(10)5-8-3-4(7)11-5/h3H,7H2,1-2H3
InChIKeyPFEZHGQTVQPARQ-UHFFFAOYSA-N
XLogP0.43
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide?
The IUPAC name of 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide (CID 83695506) is 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide?
The canonical SMILES for 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide is CN(C)C(=O)c1ncc(N)s1.
What is the InChIKey of 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide?
The InChIKey is PFEZHGQTVQPARQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-9(2)6(10)5-8-3-4(7)11-5/h3H,7H2,1-2H3.
What are the key properties of 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide?
5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide has a molecular weight of 171.22 g/mol, XLogP of 0.43, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N,N-dimethyl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 83695506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).