piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone

C19H23N3O2S2 — CID 51238680

IUPACpiperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone
SMILESO=C(c1csc(-c2ccsc2)n1)N1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C19H23N3O2S2/c23-18(21-7-2-1-3-8-21)14-4-9-22(10-5-14)19(24)16-13-26-17(20-16)15-6-11-25-12-15/h6,11-14H,1-5,7-10H2
InChIKeyGJXCOHKDANGWNI-UHFFFAOYSA-N
MW389.55 g/mol
LogP3.74
Rot. Bonds3

About piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone

piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone (PubChem CID 51238680) has the molecular formula C19H23N3O2S2 and a molecular weight of 389.55 g/mol. Its IUPAC name is piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Namepiperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone
PubChem CID51238680
Molecular FormulaC19H23N3O2S2
Molecular Weight389.55 g/mol
Exact Mass389.12
IUPAC Namepiperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone
SMILESO=C(c1csc(-c2ccsc2)n1)N1CCC(C(=O)N2CCCCC2)CC1
InChIInChI=1S/C19H23N3O2S2/c23-18(21-7-2-1-3-8-21)14-4-9-22(10-5-14)19(24)16-13-26-17(20-16)15-6-11-25-12-15/h6,11-14H,1-5,7-10H2
InChIKeyGJXCOHKDANGWNI-UHFFFAOYSA-N
XLogP3.74
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.55
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone?
The IUPAC name of piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone (CID 51238680) is piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone.
What is the SMILES notation for piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone?
The canonical SMILES for piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone is O=C(c1csc(-c2ccsc2)n1)N1CCC(C(=O)N2CCCCC2)CC1.
What is the InChIKey of piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone?
The InChIKey is GJXCOHKDANGWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2S2/c23-18(21-7-2-1-3-8-21)14-4-9-22(10-5-14)19(24)16-13-26-17(20-16)15-6-11-25-12-15/h6,11-14H,1-5,7-10H2.
What are the key properties of piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone?
piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone has a molecular weight of 389.55 g/mol, XLogP of 3.74, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-1-yl-[1-(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)piperidin-4-yl]methanone is sourced from PubChem (CID 51238680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).