N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide

C17H16FN3OS2 — CID 118618801

IUPACN-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cc2sc(N3CCCCC3)nc2s1
InChIInChI=1S/C17H16FN3OS2/c18-11-4-6-12(7-5-11)19-15(22)13-10-14-16(23-13)20-17(24-14)21-8-2-1-3-9-21/h4-7,10H,1-3,8-9H2,(H,19,22)
InChIKeyMFUVBWBUYPEOFI-UHFFFAOYSA-N
MW361.47 g/mol
LogP4.74
Rot. Bonds3

About N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide

N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 118618801) has the molecular formula C17H16FN3OS2 and a molecular weight of 361.47 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID118618801
Molecular FormulaC17H16FN3OS2
Molecular Weight361.47 g/mol
Exact Mass361.07
IUPAC NameN-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1cc2sc(N3CCCCC3)nc2s1
InChIInChI=1S/C17H16FN3OS2/c18-11-4-6-12(7-5-11)19-15(22)13-10-14-16(23-13)20-17(24-14)21-8-2-1-3-9-21/h4-7,10H,1-3,8-9H2,(H,19,22)
InChIKeyMFUVBWBUYPEOFI-UHFFFAOYSA-N
XLogP4.74
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-(Benzo[d]thiazol-2-yl)piperazin-1-yl)(thiophen-2-yl)methanone
CID 7136406
(4-(4,6-Difluorobenzo[d]thiazol-2-yl)piperazin-1-yl)(thiophen-2-yl)methanone
CID 7539638
N-[3-(dimethylamino)propyl]-N-(6-fluoro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
CID 7208625
N-(4-chlorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618374
N-(4-hydroxyphenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618390
N-(1,3-benzothiazol-2-yl)-N-(4-fluorophenyl)thiophene-2-carboxamide
CID 2356962
2-(Dimethylamino)-3-(4-fluorophenyl)-N-(propan-2-YL)-3H-thieno[2,3-D]imidazole-5-carboxamide
CID 53200484
N-cyclopentyl-2-(dimethylamino)-3-(4-fluorophenyl)-3H-thieno[2,3-d]imidazole-5-carboxamide
CID 53200486
4-[2-(Diethylamino)thieno[2,3-d][1,3]thiazole-5-carbonyl]piperazin-2-one
CID 56818542
2-(dimethylamino)-N~5~-ethyl-3-phenyl-3H-thieno[2,3-d]imidazole-5-carboxamide
CID 53200472
1-isobutyryl-N-(3-methoxybenzyl)-3,3-dimethylindoline-5-sulfonamide
CID 50841047
2-anilino-N-(4,5-dihydro-1,3-thiazol-2-yl)thieno[3,2-d][1,3]thiazole-5-carboxamide
CID 4788896

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (CID 118618801) is N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is O=C(Nc1ccc(F)cc1)c1cc2sc(N3CCCCC3)nc2s1.
What is the InChIKey of N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is MFUVBWBUYPEOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3OS2/c18-11-4-6-12(7-5-11)19-15(22)13-10-14-16(23-13)20-17(24-14)21-8-2-1-3-9-21/h4-7,10H,1-3,8-9H2,(H,19,22).
What are the key properties of N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 361.47 g/mol, XLogP of 4.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 118618801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).