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

C15H15N3O2S2 — CID 118618658

IUPAC2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3sc(N(C)C)nc3s2)cc1
InChIInChI=1S/C15H15N3O2S2/c1-18(2)15-17-14-12(22-15)8-11(21-14)13(19)16-9-4-6-10(20-3)7-5-9/h4-8H,1-3H3,(H,16,19)
InChIKeyVKUDFLNNJZEUAY-UHFFFAOYSA-N
MW333.44 g/mol
LogP3.68
Rot. Bonds4

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

2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 118618658) has the molecular formula C15H15N3O2S2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID118618658
Molecular FormulaC15H15N3O2S2
Molecular Weight333.44 g/mol
Exact Mass333.06
IUPAC Name2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2cc3sc(N(C)C)nc3s2)cc1
InChIInChI=1S/C15H15N3O2S2/c1-18(2)15-17-14-12(22-15)8-11(21-14)13(19)16-9-4-6-10(20-3)7-5-9/h4-8H,1-3H3,(H,16,19)
InChIKeyVKUDFLNNJZEUAY-UHFFFAOYSA-N
XLogP3.68
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide (CID 118618658) is 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide is COc1ccc(NC(=O)c2cc3sc(N(C)C)nc3s2)cc1.
What is the InChIKey of 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is VKUDFLNNJZEUAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2S2/c1-18(2)15-17-14-12(22-15)8-11(21-14)13(19)16-9-4-6-10(20-3)7-5-9/h4-8H,1-3H3,(H,16,19).
What are the key properties of 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide?
2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 333.44 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(4-methoxyphenyl)thieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 118618658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).