(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone

C15H17N3OS — CID 18108102

IUPAC(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
SMILESCc1nc(-c2ccccn2)sc1C(=O)N1CCCCC1
InChIInChI=1S/C15H17N3OS/c1-11-13(15(19)18-9-5-2-6-10-18)20-14(17-11)12-7-3-4-8-16-12/h3-4,7-8H,2,5-6,9-10H2,1H3
InChIKeyZNFOMKGZEDXAKV-UHFFFAOYSA-N
MW287.39 g/mol
LogP3.14
Rot. Bonds2

About (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone

(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone (PubChem CID 18108102) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
PubChem CID18108102
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone
SMILESCc1nc(-c2ccccn2)sc1C(=O)N1CCCCC1
InChIInChI=1S/C15H17N3OS/c1-11-13(15(19)18-9-5-2-6-10-18)20-14(17-11)12-7-3-4-8-16-12/h3-4,7-8H,2,5-6,9-10H2,1H3
InChIKeyZNFOMKGZEDXAKV-UHFFFAOYSA-N
XLogP3.14
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
The IUPAC name of (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone (CID 18108102) is (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone is Cc1nc(-c2ccccn2)sc1C(=O)N1CCCCC1.
What is the InChIKey of (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
The InChIKey is ZNFOMKGZEDXAKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c1-11-13(15(19)18-9-5-2-6-10-18)20-14(17-11)12-7-3-4-8-16-12/h3-4,7-8H,2,5-6,9-10H2,1H3.
What are the key properties of (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone?
(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone has a molecular weight of 287.39 g/mol, XLogP of 3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 18108102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).