4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine

C16H12N6S — CID 10041682

IUPAC4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine
SMILESNc1nc(-c2ccccn2)cn1-c1nc(-c2ccccn2)cs1
InChIInChI=1S/C16H12N6S/c17-15-20-13(11-5-1-3-7-18-11)9-22(15)16-21-14(10-23-16)12-6-2-4-8-19-12/h1-10H,(H2,17,20)
InChIKeyPMIQXHFWSXYKMN-UHFFFAOYSA-N
MW320.38 g/mol
LogP3.04
Rot. Bonds3

About 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine

4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine (PubChem CID 10041682) has the molecular formula C16H12N6S and a molecular weight of 320.38 g/mol. Its IUPAC name is 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine.

Molecular Properties

Compound Name4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine
PubChem CID10041682
Molecular FormulaC16H12N6S
Molecular Weight320.38 g/mol
Exact Mass320.08
IUPAC Name4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine
SMILESNc1nc(-c2ccccn2)cn1-c1nc(-c2ccccn2)cs1
InChIInChI=1S/C16H12N6S/c17-15-20-13(11-5-1-3-7-18-11)9-22(15)16-21-14(10-23-16)12-6-2-4-8-19-12/h1-10H,(H2,17,20)
InChIKeyPMIQXHFWSXYKMN-UHFFFAOYSA-N
XLogP3.04
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.38
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine?
The IUPAC name of 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine (CID 10041682) is 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine.
What is the SMILES notation for 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine?
The canonical SMILES for 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine is Nc1nc(-c2ccccn2)cn1-c1nc(-c2ccccn2)cs1.
What is the InChIKey of 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine?
The InChIKey is PMIQXHFWSXYKMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6S/c17-15-20-13(11-5-1-3-7-18-11)9-22(15)16-21-14(10-23-16)12-6-2-4-8-19-12/h1-10H,(H2,17,20).
What are the key properties of 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine?
4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine has a molecular weight of 320.38 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-2-yl-1-(4-pyridin-2-yl-1,3-thiazol-2-yl)imidazol-2-amine is sourced from PubChem (CID 10041682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).