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

C19H21N3O2S2 — CID 118618661

IUPACN-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(N(C)C(=O)c2cc3sc(N4CCCCC4)nc3s2)cc1
InChIInChI=1S/C19H21N3O2S2/c1-21(13-6-8-14(24-2)9-7-13)18(23)16-12-15-17(25-16)20-19(26-15)22-10-4-3-5-11-22/h6-9,12H,3-5,10-11H2,1-2H3
InChIKeyVLGQCPVUPCYLPG-UHFFFAOYSA-N
MW387.53 g/mol
LogP4.63
Rot. Bonds4

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

N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 118618661) has the molecular formula C19H21N3O2S2 and a molecular weight of 387.53 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID118618661
Molecular FormulaC19H21N3O2S2
Molecular Weight387.53 g/mol
Exact Mass387.11
IUPAC NameN-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCOc1ccc(N(C)C(=O)c2cc3sc(N4CCCCC4)nc3s2)cc1
InChIInChI=1S/C19H21N3O2S2/c1-21(13-6-8-14(24-2)9-7-13)18(23)16-12-15-17(25-16)20-19(26-15)22-10-4-3-5-11-22/h6-9,12H,3-5,10-11H2,1-2H3
InChIKeyVLGQCPVUPCYLPG-UHFFFAOYSA-N
XLogP4.63
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.53
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

CID 2093203
CID 2093203
CID 16194765
CID 16194765
CID 118618386
CID 118618386
CID 118618390
CID 118618390
CID 118618399
CID 118618399
CID 118618658
CID 118618658
CID 118618662
CID 118618662
CID 118618671
CID 118618671
CID 118618693
CID 118618693
CID 118618754
CID 118618754
CID 118618757
CID 118618757
CID 118618797
CID 118618797

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide (CID 118618661) is N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is COc1ccc(N(C)C(=O)c2cc3sc(N4CCCCC4)nc3s2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is VLGQCPVUPCYLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2S2/c1-21(13-6-8-14(24-2)9-7-13)18(23)16-12-15-17(25-16)20-19(26-15)22-10-4-3-5-11-22/h6-9,12H,3-5,10-11H2,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide?
N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 387.53 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-methyl-2-piperidin-1-ylthieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 118618661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).