2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole

C9H10N2S — CID 56636539

IUPAC2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole
SMILESCc1ccc(C2N=CCS2)cn1
InChIInChI=1S/C9H10N2S/c1-7-2-3-8(6-11-7)9-10-4-5-12-9/h2-4,6,9H,5H2,1H3
InChIKeyNKACABMRNCYORO-UHFFFAOYSA-N
MW178.26 g/mol
LogP2.21
Rot. Bonds1

About 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole

2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole (PubChem CID 56636539) has the molecular formula C9H10N2S and a molecular weight of 178.26 g/mol. Its IUPAC name is 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole.

Molecular Properties

Compound Name2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole
PubChem CID56636539
Molecular FormulaC9H10N2S
Molecular Weight178.26 g/mol
Exact Mass178.06
IUPAC Name2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole
SMILESCc1ccc(C2N=CCS2)cn1
InChIInChI=1S/C9H10N2S/c1-7-2-3-8(6-11-7)9-10-4-5-12-9/h2-4,6,9H,5H2,1H3
InChIKeyNKACABMRNCYORO-UHFFFAOYSA-N
XLogP2.21
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(aziridin-2-yl)-2-methylpyridine
CID 129016898
2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride
CID 170920850
5-(2,2-dichlorocyclopropyl)-2-methylpyridine
CID 58520620
1-[4-(6-methyl-3-pyridinyl)piperidin-1-yl]ethanone
CID 134601157
[2-(6-methyl-3-pyridinyl)cyclopropyl]methanol
CID 104824173
2-(6-methyl-3-pyridinyl)cyclobutan-1-amine
CID 81013608
1-(6-methyl-3-pyridinyl)ethanethione
CID 56619669
2-[(1S,2R)-2-(6-methyl-3-pyridinyl)cyclopropyl]acetic acid
CID 140830560
4-methyl-2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81020389
2-(6-methyl-3-pyridinyl)cyclohexane-1-carboxylic acid
CID 81008761
1-(6-methyl-3-pyridinyl)ethanone;hydrochloride
CID 67521674
2-methyl-5-(1-methylpyrrolidin-2-yl)pyridine
CID 5020711

Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole?
The IUPAC name of 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole (CID 56636539) is 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole.
What is the SMILES notation for 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole?
The canonical SMILES for 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole is Cc1ccc(C2N=CCS2)cn1.
What is the InChIKey of 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole?
The InChIKey is NKACABMRNCYORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2S/c1-7-2-3-8(6-11-7)9-10-4-5-12-9/h2-4,6,9H,5H2,1H3.
What are the key properties of 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole?
2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole has a molecular weight of 178.26 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-3-pyridinyl)-2,5-dihydro-1,3-thiazole is sourced from PubChem (CID 56636539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).