4-pyridin-4-yl-1,3-thiazol-2-amine

C8H7N3S — CID 930237

IUPAC4-pyridin-4-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccncc2)cs1
InChIInChI=1S/C8H7N3S/c9-8-11-7(5-12-8)6-1-3-10-4-2-6/h1-5H,(H2,9,11)
InChIKeyCUSJGENRTWNHPV-UHFFFAOYSA-N
MW177.23 g/mol
LogP1.79
Rot. Bonds1

About 4-pyridin-4-yl-1,3-thiazol-2-amine

4-pyridin-4-yl-1,3-thiazol-2-amine (PubChem CID 930237) has the molecular formula C8H7N3S and a molecular weight of 177.23 g/mol. Its IUPAC name is 4-pyridin-4-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-pyridin-4-yl-1,3-thiazol-2-amine
PubChem CID930237
Molecular FormulaC8H7N3S
Molecular Weight177.23 g/mol
Exact Mass177.04
IUPAC Name4-pyridin-4-yl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccncc2)cs1
InChIInChI=1S/C8H7N3S/c9-8-11-7(5-12-8)6-1-3-10-4-2-6/h1-5H,(H2,9,11)
InChIKeyCUSJGENRTWNHPV-UHFFFAOYSA-N
XLogP1.79
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Stf-62247
CID 704473
4-Phenyl-2-(4-pyridyl)thiazole
CID 738483
3-(2-(2-Methyl-4-thiazolyl)ethynyl)pyridine
CID 9794218
4-(Pyridin-2-yl)-1,3-thiazol-2-amine
CID 1092459
3-(4-Methyl-1,3-thiazol-2-yl)pyridine
CID 1201554
4-Phenyl-2-(pyridin-3-yl)thiazole
CID 701015
3-[(2-Methyl-4-thiazolyl)ethynyl]-5-vinylpyridine
CID 11608287
2-Methyl-4-(3-pyridyl)thiazole
CID 600616
4-(2,4-dimethyl-1,3-thiazol-5-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
CID 556143
(4-Phenyl-thiazol-2-yl)-pyridin-2-yl-amine
CID 750531
N-(2-ethylphenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine
CID 746667
(3-Methyl-pyridin-2-yl)-(4-pyridin-2-yl-thiazol-2-yl)-amine
CID 972880

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-4-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-pyridin-4-yl-1,3-thiazol-2-amine (CID 930237) is 4-pyridin-4-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-pyridin-4-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-pyridin-4-yl-1,3-thiazol-2-amine is Nc1nc(-c2ccncc2)cs1.
What is the InChIKey of 4-pyridin-4-yl-1,3-thiazol-2-amine?
The InChIKey is CUSJGENRTWNHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3S/c9-8-11-7(5-12-8)6-1-3-10-4-2-6/h1-5H,(H2,9,11).
What are the key properties of 4-pyridin-4-yl-1,3-thiazol-2-amine?
4-pyridin-4-yl-1,3-thiazol-2-amine has a molecular weight of 177.23 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-4-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 930237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).