4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole

C14H23N3S — CID 116965401

IUPAC4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole
SMILESCN1CCCC(c2csc(C3CCNCC3)n2)C1
InChIInChI=1S/C14H23N3S/c1-17-8-2-3-12(9-17)13-10-18-14(16-13)11-4-6-15-7-5-11/h10-12,15H,2-9H2,1H3
InChIKeyPEAKNLUUAFJYRE-UHFFFAOYSA-N
MW265.43 g/mol
LogP2.42
Rot. Bonds2

About 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole

4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole (PubChem CID 116965401) has the molecular formula C14H23N3S and a molecular weight of 265.43 g/mol. Its IUPAC name is 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole
PubChem CID116965401
Molecular FormulaC14H23N3S
Molecular Weight265.43 g/mol
Exact Mass265.16
IUPAC Name4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole
SMILESCN1CCCC(c2csc(C3CCNCC3)n2)C1
InChIInChI=1S/C14H23N3S/c1-17-8-2-3-12(9-17)13-10-18-14(16-13)11-4-6-15-7-5-11/h10-12,15H,2-9H2,1H3
InChIKeyPEAKNLUUAFJYRE-UHFFFAOYSA-N
XLogP2.42
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.43
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylpyrrolidin-3-yl)-4-pyrrolidin-3-yl-1,3-thiazole
CID 116888678
4-cyclohexyl-2-piperidin-4-yl-1,3-thiazole;hydrochloride
CID 120558204
2,4-di(cyclobutyl)-1,3-thiazole
CID 130688661
2-(azetidin-3-yl)-4-(1-methylpiperidin-4-yl)-1,3-thiazole
CID 115042295
2,4-di(pyrrolidin-3-yl)-1,3-thiazole
CID 115034162
4-(oxan-4-yl)-2-piperidin-4-yl-1,3-thiazole
CID 116965399
3-[4-(1-methylpyrrolidin-3-yl)-1,3-thiazol-2-yl]morpholine
CID 116966504
2-amino-2-[4-(1-methylpiperidin-3-yl)-1,3-thiazol-2-yl]ethanol
CID 116966796
4-methyl-6-(1-methylpiperidin-3-yl)-2-pyrrolidin-3-ylpyrimidine
CID 116893403
3-methyl-3-[2-(1-methylpiperidin-3-yl)-1,3-thiazol-4-yl]butan-1-amine
CID 116888471
4-(oxolan-3-yl)-2-piperidin-4-yl-1,3-thiazole
CID 104749815
4-(1-methylpyrazol-4-yl)-2-piperidin-4-yl-1,3-thiazole
CID 55084668

Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole?
The IUPAC name of 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole (CID 116965401) is 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole.
What is the SMILES notation for 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole?
The canonical SMILES for 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole is CN1CCCC(c2csc(C3CCNCC3)n2)C1.
What is the InChIKey of 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole?
The InChIKey is PEAKNLUUAFJYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3S/c1-17-8-2-3-12(9-17)13-10-18-14(16-13)11-4-6-15-7-5-11/h10-12,15H,2-9H2,1H3.
What are the key properties of 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole?
4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole has a molecular weight of 265.43 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpiperidin-3-yl)-2-piperidin-4-yl-1,3-thiazole is sourced from PubChem (CID 116965401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).