2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine

C11H19N3S — CID 116965536

IUPAC2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine
SMILESCc1csc(C2CCN(CCN)CC2)n1
InChIInChI=1S/C11H19N3S/c1-9-8-15-11(13-9)10-2-5-14(6-3-10)7-4-12/h8,10H,2-7,12H2,1H3
InChIKeyWKXMMPVGVZOSLT-UHFFFAOYSA-N
MW225.36 g/mol
LogP1.59
Rot. Bonds3

About 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine

2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine (PubChem CID 116965536) has the molecular formula C11H19N3S and a molecular weight of 225.36 g/mol. Its IUPAC name is 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine
PubChem CID116965536
Molecular FormulaC11H19N3S
Molecular Weight225.36 g/mol
Exact Mass225.13
IUPAC Name2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine
SMILESCc1csc(C2CCN(CCN)CC2)n1
InChIInChI=1S/C11H19N3S/c1-9-8-15-11(13-9)10-2-5-14(6-3-10)7-4-12/h8,10H,2-7,12H2,1H3
InChIKeyWKXMMPVGVZOSLT-UHFFFAOYSA-N
XLogP1.59
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-2-(1-propan-2-ylpiperidin-4-yl)-1,3-thiazole
CID 58547619
1-(2,6-difluorophenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanol
CID 110912986
4-methyl-2-piperidin-4-yl-1,3-thiazole
CID 23404938
1-(3,4-difluorophenyl)-2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanol
CID 110912985
2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)piperidin-1-yl]ethanamine
CID 116885347
(2S)-2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]butanoic acid
CID 124623176
1-[2-hydroxy-3-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]propyl]pyrrolidin-2-one
CID 111116494
ethyl (3R)-3-hydroxy-4-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]-4-oxobutanoate
CID 124847429
2-[1-(4-ethylsulfonylphenyl)sulfonylpiperidin-4-yl]-4-methyl-1,3-thiazole
CID 56510041
2-(1-pentylpiperidin-4-yl)-1,3-thiazole-4-carboxylic acid
CID 142706070
1-[4-[2-[1-(2-hydroxyethyl)piperidin-4-yl]-1,3-thiazol-4-yl]phenyl]ethanone
CID 22893123
4-methyl-2-(3-methylidenecyclobutyl)-1,3-thiazole
CID 167193666

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine?
The IUPAC name of 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine (CID 116965536) is 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine?
The canonical SMILES for 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine is Cc1csc(C2CCN(CCN)CC2)n1.
What is the InChIKey of 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine?
The InChIKey is WKXMMPVGVZOSLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3S/c1-9-8-15-11(13-9)10-2-5-14(6-3-10)7-4-12/h8,10H,2-7,12H2,1H3.
What are the key properties of 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine?
2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine has a molecular weight of 225.36 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanamine is sourced from PubChem (CID 116965536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).