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

C17H17N3O3S2 — CID 118618662

IUPACN-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3sc(N4CCOCC4)nc3s2)cc1
InChIInChI=1S/C17H17N3O3S2/c1-22-12-4-2-11(3-5-12)18-15(21)13-10-14-16(24-13)19-17(25-14)20-6-8-23-9-7-20/h2-5,10H,6-9H2,1H3,(H,18,21)
InChIKeyJFWCUEAPEURKCR-UHFFFAOYSA-N
MW375.48 g/mol
LogP3.46
Rot. Bonds4

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

N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 118618662) has the molecular formula C17H17N3O3S2 and a molecular weight of 375.48 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID118618662
Molecular FormulaC17H17N3O3S2
Molecular Weight375.48 g/mol
Exact Mass375.07
IUPAC NameN-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3sc(N4CCOCC4)nc3s2)cc1
InChIInChI=1S/C17H17N3O3S2/c1-22-12-4-2-11(3-5-12)18-15(21)13-10-14-16(24-13)19-17(25-14)20-6-8-23-9-7-20/h2-5,10H,6-9H2,1H3,(H,18,21)
InChIKeyJFWCUEAPEURKCR-UHFFFAOYSA-N
XLogP3.46
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.48
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Ethyl 2-[(4-methoxyphenyl)amino]thieno[3,2-d][1,3]thiazole-5-carboxylate
CID 1255139
Antitubercular agent-25
CID 102593986
2-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-1,3-benzoxazol-5-yl)thieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618294
N-(4-methoxyphenyl)-2-piperazin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618386
N-(4-hydroxyphenyl)-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
CID 118618390
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
4-methoxy-N-[(2-piperidin-1-ylthieno[2,3-d][1,3]thiazol-5-yl)methyl]aniline
CID 118618671
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
Antitubercular agent-24
CID 118618757

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (CID 118618662) is N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is COc1ccc(NC(=O)c2cc3sc(N4CCOCC4)nc3s2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is JFWCUEAPEURKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O3S2/c1-22-12-4-2-11(3-5-12)18-15(21)13-10-14-16(24-13)19-17(25-14)20-6-8-23-9-7-20/h2-5,10H,6-9H2,1H3,(H,18,21).
What are the key properties of N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 375.48 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-morpholin-4-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 118618662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).