3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole

C10H16N2S — CID 165443959

IUPAC3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole
SMILESCc1cc(C2CCCC(C)N2)sn1
InChIInChI=1S/C10H16N2S/c1-7-4-3-5-9(11-7)10-6-8(2)12-13-10/h6-7,9,11H,3-5H2,1-2H3
InChIKeyCMDIGNPCICECLG-UHFFFAOYSA-N
MW196.32 g/mol
LogP2.65
Rot. Bonds1

About 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole

3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole (PubChem CID 165443959) has the molecular formula C10H16N2S and a molecular weight of 196.32 g/mol. Its IUPAC name is 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole.

Molecular Properties

Compound Name3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole
PubChem CID165443959
Molecular FormulaC10H16N2S
Molecular Weight196.32 g/mol
Exact Mass196.10
IUPAC Name3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole
SMILESCc1cc(C2CCCC(C)N2)sn1
InChIInChI=1S/C10H16N2S/c1-7-4-3-5-9(11-7)10-6-8(2)12-13-10/h6-7,9,11H,3-5H2,1-2H3
InChIKeyCMDIGNPCICECLG-UHFFFAOYSA-N
XLogP2.65
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.32
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole?
The IUPAC name of 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole (CID 165443959) is 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole.
What is the SMILES notation for 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole?
The canonical SMILES for 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole is Cc1cc(C2CCCC(C)N2)sn1.
What is the InChIKey of 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole?
The InChIKey is CMDIGNPCICECLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S/c1-7-4-3-5-9(11-7)10-6-8(2)12-13-10/h6-7,9,11H,3-5H2,1-2H3.
What are the key properties of 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole?
3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole has a molecular weight of 196.32 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(6-methylpiperidin-2-yl)-1,2-thiazole is sourced from PubChem (CID 165443959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).