2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole

C14H17N3S — CID 141070519

IUPAC2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole
SMILESCc1nc(C2CCNCC2)c(-c2ccccn2)s1
InChIInChI=1S/C14H17N3S/c1-10-17-13(11-5-8-15-9-6-11)14(18-10)12-4-2-3-7-16-12/h2-4,7,11,15H,5-6,8-9H2,1H3
InChIKeyUJESMFNWZMBDFX-UHFFFAOYSA-N
MW259.38 g/mol
LogP2.98
Rot. Bonds2

About 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole

2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole (PubChem CID 141070519) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole.

Molecular Properties

Compound Name2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole
PubChem CID141070519
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC Name2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole
SMILESCc1nc(C2CCNCC2)c(-c2ccccn2)s1
InChIInChI=1S/C14H17N3S/c1-10-17-13(11-5-8-15-9-6-11)14(18-10)12-4-2-3-7-16-12/h2-4,7,11,15H,5-6,8-9H2,1H3
InChIKeyUJESMFNWZMBDFX-UHFFFAOYSA-N
XLogP2.98
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-5-pyridin-2-yl-1,3-thiazol-4-amine
CID 82373528
2-methyl-4-piperidin-4-yl-1,3-thiazole-5-carboxylic acid
CID 105484003
2-(5-piperidin-4-yl-1,3,4-thiadiazol-2-yl)-3-pyridin-2-yl-4H-thieno[3,2-b]pyrrole
CID 175940278
5-pyridin-2-yl-3-[(3R)-pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 99727844
5-pyridin-2-yl-3-pyrrolidin-3-yl-1,2,4-oxadiazole
CID 86820421
5-pyridin-2-yl-3-[(3S)-pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 99727845
2-(piperidin-4-ylmethyl)-4-pyridin-2-yl-1,3-thiazole
CID 116828962
2-piperidin-4-yl-6-(1H-pyrazol-5-yl)pyridine
CID 110095015
(4-cyclopropyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methanamine
CID 82436315
5-methyl-2-phenyl-4-piperidin-4-yl-1,3-oxazole
CID 115044754
3-piperidin-4-yl-N-pyrimidin-2-ylpyrazin-2-amine
CID 175662251
4-methyl-5-pyridin-2-yl-3H-1,3-thiazole-2-thione
CID 82161852

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole?
The IUPAC name of 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole (CID 141070519) is 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole.
What is the SMILES notation for 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole?
The canonical SMILES for 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole is Cc1nc(C2CCNCC2)c(-c2ccccn2)s1.
What is the InChIKey of 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole?
The InChIKey is UJESMFNWZMBDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c1-10-17-13(11-5-8-15-9-6-11)14(18-10)12-4-2-3-7-16-12/h2-4,7,11,15H,5-6,8-9H2,1H3.
What are the key properties of 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole?
2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole has a molecular weight of 259.38 g/mol, XLogP of 2.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-piperidin-4-yl-5-pyridin-2-yl-1,3-thiazole is sourced from PubChem (CID 141070519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).