5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine

C9H14FN3S — CID 106634978

IUPAC5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine
SMILESNc1ncc(C(F)C2CCCCN2)s1
InChIInChI=1S/C9H14FN3S/c10-8(6-3-1-2-4-12-6)7-5-13-9(11)14-7/h5-6,8,12H,1-4H2,(H2,11,13)
InChIKeyRGZUEFGDUIYZOI-UHFFFAOYSA-N
MW215.30 g/mol
LogP1.88
Rot. Bonds2

About 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine

5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 106634978) has the molecular formula C9H14FN3S and a molecular weight of 215.30 g/mol. Its IUPAC name is 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine
PubChem CID106634978
Molecular FormulaC9H14FN3S
Molecular Weight215.30 g/mol
Exact Mass215.09
IUPAC Name5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine
SMILESNc1ncc(C(F)C2CCCCN2)s1
InChIInChI=1S/C9H14FN3S/c10-8(6-3-1-2-4-12-6)7-5-13-9(11)14-7/h5-6,8,12H,1-4H2,(H2,11,13)
InChIKeyRGZUEFGDUIYZOI-UHFFFAOYSA-N
XLogP1.88
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[fluoro(piperidin-2-yl)methyl]pyrazine
CID 106635051
1-(2-piperidin-2-yl-1,3-thiazol-5-yl)ethanamine
CID 115090671
2-[fluoro-(5-methylthiophen-3-yl)methyl]piperidine
CID 106635079
3-[fluoro(piperidin-2-yl)methyl]-5-methoxypyridine
CID 106634961
2-chloro-5-[fluoro(pyrrolidin-2-yl)methyl]-1-methylimidazole
CID 164644961
2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
CID 106634971
2-[1-benzofuran-2-yl(fluoro)methyl]piperidine
CID 106635014
ethane;5-propan-2-yl-1,3-thiazol-2-amine
CID 178111483
(4-fluorophenyl)-piperidin-2-ylmethanamine
CID 116935636
2-[cyclopropyl(fluoro)methyl]azepane
CID 105434879
5-(2,4-dimethylpentan-3-yl)-1,3-thiazol-2-amine
CID 130517381
5-piperidin-2-ylpyrimidin-2-amine
CID 82409904

Frequently Asked Questions

What is the IUPAC name of 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine (CID 106634978) is 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine is Nc1ncc(C(F)C2CCCCN2)s1.
What is the InChIKey of 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is RGZUEFGDUIYZOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN3S/c10-8(6-3-1-2-4-12-6)7-5-13-9(11)14-7/h5-6,8,12H,1-4H2,(H2,11,13).
What are the key properties of 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine?
5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 215.30 g/mol, XLogP of 1.88, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[fluoro(piperidin-2-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 106634978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).