5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole

C10H15FN2S — CID 126793861

IUPAC5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
SMILESFCC1CCN(Cc2cncs2)CC1
InChIInChI=1S/C10H15FN2S/c11-5-9-1-3-13(4-2-9)7-10-6-12-8-14-10/h6,8-9H,1-5,7H2
InChIKeyWNBSWQIFSPYVAB-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.32
Rot. Bonds3

About 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole

5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole (PubChem CID 126793861) has the molecular formula C10H15FN2S and a molecular weight of 214.31 g/mol. Its IUPAC name is 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole.

Molecular Properties

Compound Name5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
PubChem CID126793861
Molecular FormulaC10H15FN2S
Molecular Weight214.31 g/mol
Exact Mass214.09
IUPAC Name5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
SMILESFCC1CCN(Cc2cncs2)CC1
InChIInChI=1S/C10H15FN2S/c11-5-9-1-3-13(4-2-9)7-10-6-12-8-14-10/h6,8-9H,1-5,7H2
InChIKeyWNBSWQIFSPYVAB-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-[(2-Chloro-1,3-thiazol-5-yl)methyl]-2-methylpiperidine
CID 4616493
1-[(2-Chloro-1,3-thiazol-5-yl)methyl]-4-methylpiperidine
CID 1481531
1-[(2-Chloro-1,3-thiazol-5-yl)methyl]-3-methylpiperidine
CID 3736777
2-chloro-5-[[(3R)-3-methylpiperidin-1-yl]methyl]-1,3-thiazole
CID 1481538
N-methyl-1-(1-methylpyrrolidin-3-yl)-N-(1,3-thiazol-5-ylmethyl)methanamine
CID 119039424
2-Tert-butyl-5-[(3,3-difluoropiperidin-1-yl)methyl]-1,3-thiazole
CID 146338346
5-[(3,3-Difluoropiperidin-1-yl)methyl]-2-methyl-1,3-thiazole;ethane
CID 153556178
1-(1,3-Thiazol-5-ylmethyl)-4-(trifluoromethyl)piperidin-4-ol
CID 75500662
5-[[2,2-Dimethyl-4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazole
CID 75506976
2-Chloro-5-[[3-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
CID 79764597
2-Chloro-5-[[4-(trifluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole
CID 79764598
2-Chloro-5-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]-1,3-thiazole
CID 79765483

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
The IUPAC name of 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole (CID 126793861) is 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole.
What is the SMILES notation for 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
The canonical SMILES for 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole is FCC1CCN(Cc2cncs2)CC1.
What is the InChIKey of 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
The InChIKey is WNBSWQIFSPYVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2S/c11-5-9-1-3-13(4-2-9)7-10-6-12-8-14-10/h6,8-9H,1-5,7H2.
What are the key properties of 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole?
5-[[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 5-[[4-(fluoromethyl)piperidin-1-yl]methyl]-1,3-thiazole is sourced from PubChem (CID 126793861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).