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

C19H21N3O2S2 — CID 118618797

IUPACN-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(CNC(=O)c2cc3sc(N4CCCCC4)nc3s2)cc1
InChIInChI=1S/C19H21N3O2S2/c1-24-14-7-5-13(6-8-14)12-20-17(23)15-11-16-18(25-15)21-19(26-16)22-9-3-2-4-10-22/h5-8,11H,2-4,9-10,12H2,1H3,(H,20,23)
InChIKeyKFIKZJHIIZFDGF-UHFFFAOYSA-N
MW387.53 g/mol
LogP4.29
Rot. Bonds5

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

N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 118618797) has the molecular formula C19H21N3O2S2 and a molecular weight of 387.53 g/mol. Its IUPAC name is N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID118618797
Molecular FormulaC19H21N3O2S2
Molecular Weight387.53 g/mol
Exact Mass387.11
IUPAC NameN-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(CNC(=O)c2cc3sc(N4CCCCC4)nc3s2)cc1
InChIInChI=1S/C19H21N3O2S2/c1-24-14-7-5-13(6-8-14)12-20-17(23)15-11-16-18(25-15)21-19(26-16)22-9-3-2-4-10-22/h5-8,11H,2-4,9-10,12H2,1H3,(H,20,23)
InChIKeyKFIKZJHIIZFDGF-UHFFFAOYSA-N
XLogP4.29
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 862702
N-{2-[2-(4-methoxyphenyl)-4-methyl-1,3-thiazol-5-yl]ethyl}thiophene-2-carboxamide
CID 7202380
1-(4-(4-Methoxybenzyl)-2-phenyl-4H-pyrrolo[2,3-d]thiazole-5-carbonyl)-N-propylpiperidine-4-carboxamide
CID 137640580
1-(2-Bromo-4-(4-methoxybenzyl)-4H-pyrrolo[2,3-d]thiazole-5-carbonyl)-N-propylpiperidine-4-carboxamide
CID 137648603
1-(4-(4-Methoxybenzyl)-4H-pyrrolo[2,3-d]thiazole-5-carbonyl)-N-propylpiperidine-4-carboxamide
CID 137658791
N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618386
N-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618399
2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618658
N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618661
N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618662
4-methoxy-N-(2-piperidin-1-ylthieno[2,3-d][1,3]thiazol-5-yl)benzamide
CID 118618693
N-(3,5-dimethoxyphenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618754

Frequently Asked Questions

What is the IUPAC name of N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (CID 118618797) is N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is COc1ccc(CNC(=O)c2cc3sc(N4CCCCC4)nc3s2)cc1.
What is the InChIKey of N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is KFIKZJHIIZFDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2S2/c1-24-14-7-5-13(6-8-14)12-20-17(23)15-11-16-18(25-15)21-19(26-16)22-9-3-2-4-10-22/h5-8,11H,2-4,9-10,12H2,1H3,(H,20,23).
What are the key properties of N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 387.53 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methoxyphenyl)methyl]-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 118618797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).