2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine

C9H9N3S — CID 83108842

IUPAC2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine
SMILESCc1cnccc1-c1nc(N)cs1
InChIInChI=1S/C9H9N3S/c1-6-4-11-3-2-7(6)9-12-8(10)5-13-9/h2-5H,10H2,1H3
InChIKeyLSHVERBXAYUERF-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.10
Rot. Bonds1

About 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine

2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine (PubChem CID 83108842) has the molecular formula C9H9N3S and a molecular weight of 191.26 g/mol. Its IUPAC name is 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine
PubChem CID83108842
Molecular FormulaC9H9N3S
Molecular Weight191.26 g/mol
Exact Mass191.05
IUPAC Name2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine
SMILESCc1cnccc1-c1nc(N)cs1
InChIInChI=1S/C9H9N3S/c1-6-4-11-3-2-7(6)9-12-8(10)5-13-9/h2-5H,10H2,1H3
InChIKeyLSHVERBXAYUERF-UHFFFAOYSA-N
XLogP2.10
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Stf-62247
CID 704473
3-(2-(2-Methyl-4-thiazolyl)ethynyl)pyridine
CID 9794218
3-(4-Methyl-1,3-thiazol-2-yl)pyridine
CID 1201554
3-[(2-Methyl-4-thiazolyl)ethynyl]-5-vinylpyridine
CID 11608287
2-Methyl-4-(3-pyridyl)thiazole
CID 600616
(4-Phenyl-thiazol-2-yl)-pyridin-2-yl-amine
CID 750531
4-(Pyridin-4-yl)-1,3-thiazol-2-amine
CID 930237
N-(1,3-Thiazol-2-yl)pyridin-2-amine 1
CID 5329323
N-(3-methylpyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329391
N-(4-methylpyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329392
N-(5-methylpyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329393
N-(6-methylpyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329394

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine?
The IUPAC name of 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine (CID 83108842) is 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine?
The canonical SMILES for 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine is Cc1cnccc1-c1nc(N)cs1.
What is the InChIKey of 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine?
The InChIKey is LSHVERBXAYUERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3S/c1-6-4-11-3-2-7(6)9-12-8(10)5-13-9/h2-5H,10H2,1H3.
What are the key properties of 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine?
2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine has a molecular weight of 191.26 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-4-pyridinyl)-1,3-thiazol-4-amine is sourced from PubChem (CID 83108842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).