5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole

C15H17FN2S — CID 93202830

IUPAC5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole
SMILESFc1cccc(Cc2cnc(C3CCNCC3)s2)c1
InChIInChI=1S/C15H17FN2S/c16-13-3-1-2-11(8-13)9-14-10-18-15(19-14)12-4-6-17-7-5-12/h1-3,8,10,12,17H,4-7,9H2
InChIKeyNVBHGQPCLHMQKY-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.34
Rot. Bonds3

About 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole

5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole (PubChem CID 93202830) has the molecular formula C15H17FN2S and a molecular weight of 276.38 g/mol. Its IUPAC name is 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole.

Molecular Properties

Compound Name5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole
PubChem CID93202830
Molecular FormulaC15H17FN2S
Molecular Weight276.38 g/mol
Exact Mass276.11
IUPAC Name5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole
SMILESFc1cccc(Cc2cnc(C3CCNCC3)s2)c1
InChIInChI=1S/C15H17FN2S/c16-13-3-1-2-11(8-13)9-14-10-18-15(19-14)12-4-6-17-7-5-12/h1-3,8,10,12,17H,4-7,9H2
InChIKeyNVBHGQPCLHMQKY-UHFFFAOYSA-N
XLogP3.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4-fluorophenyl)-2-piperidin-4-yl-1,3-thiazole
CID 118427022
3-[(5-piperidin-4-yl-1,3-thiazol-2-yl)methyl]benzonitrile
CID 18187788
2-benzyl-5-piperidin-4-yl-1,3-thiazole
CID 18187536
2-[(3-methoxyphenyl)methyl]-5-piperidin-4-yl-1,3-thiazole
CID 18187785
N-[(3-fluorophenyl)methyl]-2-piperidin-4-ylpyridin-4-amine
CID 95825266
3-[(3-fluorophenyl)methyl]-5-[(3R)-pyrrolidin-3-yl]-1,2,4-oxadiazole
CID 120893894
N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-2-hydroxycyclopentane-1-carboxamide
CID 110015330
4-[(4-fluorophenyl)methyl]-2-piperidin-4-ylpyridine
CID 95844382
2-(3-fluorophenyl)-N-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]acetamide
CID 39221992
5-[(3-fluorophenyl)methyl]-2-piperazin-1-ylpyrimidine
CID 117224214
5-benzyl-N-(6-piperidin-4-yl-2-pyridinyl)-1,3-thiazol-2-amine;dihydrochloride
CID 167995606
5-(1,1-difluoroethyl)-2-piperidin-4-yl-1,3-thiazole
CID 84795516

Frequently Asked Questions

What is the IUPAC name of 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole?
The IUPAC name of 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole (CID 93202830) is 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole.
What is the SMILES notation for 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole?
The canonical SMILES for 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole is Fc1cccc(Cc2cnc(C3CCNCC3)s2)c1.
What is the InChIKey of 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole?
The InChIKey is NVBHGQPCLHMQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2S/c16-13-3-1-2-11(8-13)9-14-10-18-15(19-14)12-4-6-17-7-5-12/h1-3,8,10,12,17H,4-7,9H2.
What are the key properties of 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole?
5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole has a molecular weight of 276.38 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-fluorophenyl)methyl]-2-piperidin-4-yl-1,3-thiazole is sourced from PubChem (CID 93202830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).