N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride

C15H17ClFN3OS — CID 69168862

IUPACN-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(F)cc1)c1csc(N2CCCCC2)n1
InChIInChI=1S/C15H16FN3OS.ClH/c16-11-4-6-12(7-5-11)17-14(20)13-10-21-15(18-13)19-8-2-1-3-9-19;/h4-7,10H,1-3,8-9H2,(H,17,20);1H
InChIKeyPZCKSFAHWVKPSZ-UHFFFAOYSA-N
MW341.84 g/mol
LogP3.95
Rot. Bonds3

About N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride

N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride (PubChem CID 69168862) has the molecular formula C15H17ClFN3OS and a molecular weight of 341.84 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride
PubChem CID69168862
Molecular FormulaC15H17ClFN3OS
Molecular Weight341.84 g/mol
Exact Mass341.08
IUPAC NameN-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(F)cc1)c1csc(N2CCCCC2)n1
InChIInChI=1S/C15H16FN3OS.ClH/c16-11-4-6-12(7-5-11)17-14(20)13-10-21-15(18-13)19-8-2-1-3-9-19;/h4-7,10H,1-3,8-9H2,(H,17,20);1H
InChIKeyPZCKSFAHWVKPSZ-UHFFFAOYSA-N
XLogP3.95
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride?
The IUPAC name of N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride (CID 69168862) is N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride?
The canonical SMILES for N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(F)cc1)c1csc(N2CCCCC2)n1.
What is the InChIKey of N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride?
The InChIKey is PZCKSFAHWVKPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3OS.ClH/c16-11-4-6-12(7-5-11)17-14(20)13-10-21-15(18-13)19-8-2-1-3-9-19;/h4-7,10H,1-3,8-9H2,(H,17,20);1H.
What are the key properties of N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride?
N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride has a molecular weight of 341.84 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-piperidin-1-yl-1,3-thiazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 69168862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).