6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide

C10H12N4OS — CID 11195710

IUPAC6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCC(C)=NNC(=O)c1c(C)nc2sccn12
InChIInChI=1S/C10H12N4OS/c1-6(2)12-13-9(15)8-7(3)11-10-14(8)4-5-16-10/h4-5H,1-3H3,(H,13,15)
InChIKeyWFJNJBLPRCAVIV-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.83
Rot. Bonds2

About 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide

6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 11195710) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID11195710
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCC(C)=NNC(=O)c1c(C)nc2sccn12
InChIInChI=1S/C10H12N4OS/c1-6(2)12-13-9(15)8-7(3)11-10-14(8)4-5-16-10/h4-5H,1-3H3,(H,13,15)
InChIKeyWFJNJBLPRCAVIV-UHFFFAOYSA-N
XLogP1.83
TPSA58.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 11195710) is 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide is CC(C)=NNC(=O)c1c(C)nc2sccn12.
What is the InChIKey of 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is WFJNJBLPRCAVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-6(2)12-13-9(15)8-7(3)11-10-14(8)4-5-16-10/h4-5H,1-3H3,(H,13,15).
What are the key properties of 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide?
6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 236.30 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(propan-2-ylideneamino)imidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 11195710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).