4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine

C10H10N4S — CID 5473672

IUPAC4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine
SMILESCc1csc(N/N=C\c2cccnc2)n1
InChIInChI=1S/C10H10N4S/c1-8-7-15-10(13-8)14-12-6-9-3-2-4-11-5-9/h2-7H,1H3,(H,13,14)/b12-6-
InChIKeyYPGIPIUERQQZJE-SDQBBNPISA-N
MW218.29 g/mol
LogP2.29
Rot. Bonds3

About 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine

4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine (PubChem CID 5473672) has the molecular formula C10H10N4S and a molecular weight of 218.29 g/mol. Its IUPAC name is 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine
PubChem CID5473672
Molecular FormulaC10H10N4S
Molecular Weight218.29 g/mol
Exact Mass218.06
IUPAC Name4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine
SMILESCc1csc(N/N=C\c2cccnc2)n1
InChIInChI=1S/C10H10N4S/c1-8-7-15-10(13-8)14-12-6-9-3-2-4-11-5-9/h2-7H,1H3,(H,13,14)/b12-6-
InChIKeyYPGIPIUERQQZJE-SDQBBNPISA-N
XLogP2.29
TPSA50.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 52.29
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 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine (CID 5473672) is 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine is Cc1csc(N/N=C\c2cccnc2)n1.
What is the InChIKey of 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine?
The InChIKey is YPGIPIUERQQZJE-SDQBBNPISA-N. The full InChI is InChI=1S/C10H10N4S/c1-8-7-15-10(13-8)14-12-6-9-3-2-4-11-5-9/h2-7H,1H3,(H,13,14)/b12-6-.
What are the key properties of 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine?
4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine has a molecular weight of 218.29 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(Z)-pyridin-3-ylmethylideneamino]-1,3-thiazol-2-amine is sourced from PubChem (CID 5473672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).