4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole

C10H15FN2S — CID 126793860

IUPAC4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
SMILESFCC1CCN(Cc2cscn2)CC1
InChIInChI=1S/C10H15FN2S/c11-5-9-1-3-13(4-2-9)6-10-7-14-8-12-10/h7-9H,1-6H2
InChIKeyWAUFLVGEQZSJQA-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.32
Rot. Bonds3

About 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole

4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole (PubChem CID 126793860) has the molecular formula C10H15FN2S and a molecular weight of 214.31 g/mol. Its IUPAC name is 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole.

Molecular Properties

Compound Name4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
PubChem CID126793860
Molecular FormulaC10H15FN2S
Molecular Weight214.31 g/mol
Exact Mass214.09
IUPAC Name4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
SMILESFCC1CCN(Cc2cscn2)CC1
InChIInChI=1S/C10H15FN2S/c11-5-9-1-3-13(4-2-9)6-10-7-14-8-12-10/h7-9H,1-6H2
InChIKeyWAUFLVGEQZSJQA-UHFFFAOYSA-N
XLogP2.32
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-((1,3-Thiazol-4-yl)methyl)piperazine
CID 28781798
1-((1,3-Thiazol-4-yl)methyl)piperidin-4-amine
CID 43556525
{1-[(2-Methyl-1,3-thiazol-4-yl)methyl]piperidin-4-yl}methanamine
CID 50987749
4-(Piperidin-1-ylmethyl)-2-propan-2-yl-1,3-thiazole
CID 53523916
1-[(2-Methyl-1,3-thiazol-4-yl)methyl]piperidine
CID 5019947
4-[(4-Methyl-1,4-diazaspiro[5.5]undecan-1-yl)methyl]-1,3-thiazole
CID 71977147
1-[1-(2-methoxyethyl)piperidin-4-yl]-N-methyl-N-(1,3-thiazol-4-ylmethyl)methanamine
CID 77079650
4-[[(3S)-3-(2-methylpropyl)pyrrolidin-1-yl]methyl]-1,3-thiazole
CID 97319043
4-[[(3S)-3-piperidin-1-ylpyrrolidin-1-yl]methyl]-1,3-thiazole
CID 99973505
2-Cyclopropyl-4-((4-(trifluoromethyl)piperidin-1-yl)methyl)thiazole
CID 121020644
cis-(1S,2R)-N-methyl-N-(1,3-thiazol-4-ylmethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 137984833
4-[(4-Propan-2-ylpiperidin-1-yl)methyl]-2-(trifluoromethyl)-1,3-thiazole
CID 58395264

Frequently Asked Questions

What is the IUPAC name of 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
The IUPAC name of 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole (CID 126793860) is 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole.
What is the SMILES notation for 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
The canonical SMILES for 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole is FCC1CCN(Cc2cscn2)CC1.
What is the InChIKey of 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
The InChIKey is WAUFLVGEQZSJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2S/c11-5-9-1-3-13(4-2-9)6-10-7-14-8-12-10/h7-9H,1-6H2.
What are the key properties of 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole has a molecular weight of 214.31 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole is sourced from PubChem (CID 126793860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).