4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride

C19H24ClFN2OS — CID 119559585

IUPAC4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride
SMILESCc1sc(C(=O)NCCC2CCCNC2)cc1-c1ccc(F)cc1.Cl
InChIInChI=1S/C19H23FN2OS.ClH/c1-13-17(15-4-6-16(20)7-5-15)11-18(24-13)19(23)22-10-8-14-3-2-9-21-12-14;/h4-7,11,14,21H,2-3,8-10,12H2,1H3,(H,22,23);1H
InChIKeyKAXOTLPTKNOCHI-UHFFFAOYSA-N
MW382.93 g/mol
LogP4.40
Rot. Bonds5

About 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride

4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride (PubChem CID 119559585) has the molecular formula C19H24ClFN2OS and a molecular weight of 382.93 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride
PubChem CID119559585
Molecular FormulaC19H24ClFN2OS
Molecular Weight382.93 g/mol
Exact Mass382.13
IUPAC Name4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride
SMILESCc1sc(C(=O)NCCC2CCCNC2)cc1-c1ccc(F)cc1.Cl
InChIInChI=1S/C19H23FN2OS.ClH/c1-13-17(15-4-6-16(20)7-5-15)11-18(24-13)19(23)22-10-8-14-3-2-9-21-12-14;/h4-7,11,14,21H,2-3,8-10,12H2,1H3,(H,22,23);1H
InChIKeyKAXOTLPTKNOCHI-UHFFFAOYSA-N
XLogP4.40
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.93
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-methoxyphenyl)-5-methyl-N-(2-pyrrolidin-3-ylethyl)thiophene-2-carboxamide
CID 119533300
4-(4-fluorophenyl)-5-methyl-N-pyrrolidin-3-ylthiophene-2-carboxamide;hydrochloride
CID 119454424
5-fluoro-2-methyl-N-(2-piperidin-3-ylethyl)benzamide
CID 55144401
5-methyl-4-nitro-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide
CID 119557591
1-(4-fluorophenyl)-3-methyl-N-(2-piperidin-3-ylethyl)thieno[3,2-d]pyrazole-5-carboxamide;hydrochloride
CID 119554944
3-fluoro-4-methyl-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119556963
2-(2,5-difluorophenyl)-N-(2-piperidin-3-ylethyl)acetamide;hydrochloride
CID 119556858
4-fluoro-2-iodo-N-(2-piperidin-3-ylethyl)benzamide
CID 103806776
2-(4-fluorophenyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119556217
2-(4-fluorophenyl)-N-(2-piperidin-3-ylethyl)acetamide
CID 60894094
2-(2,5-difluorophenyl)-N-(2-piperidin-3-ylethyl)acetamide
CID 119556859
6-fluoro-N-(2-pyrrolidin-3-ylethyl)-1-benzothiophene-2-carboxamide
CID 81105185

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride?
The IUPAC name of 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride (CID 119559585) is 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride is Cc1sc(C(=O)NCCC2CCCNC2)cc1-c1ccc(F)cc1.Cl.
What is the InChIKey of 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride?
The InChIKey is KAXOTLPTKNOCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2OS.ClH/c1-13-17(15-4-6-16(20)7-5-15)11-18(24-13)19(23)22-10-8-14-3-2-9-21-12-14;/h4-7,11,14,21H,2-3,8-10,12H2,1H3,(H,22,23);1H.
What are the key properties of 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride?
4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride has a molecular weight of 382.93 g/mol, XLogP of 4.40, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-5-methyl-N-(2-piperidin-3-ylethyl)thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119559585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).