4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide

C18H20N4OS — CID 71657233

IUPAC4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESCc1csc(NC(=O)N2CCC(n3ccc4ccccc43)CC2)n1
InChIInChI=1S/C18H20N4OS/c1-13-12-24-17(19-13)20-18(23)21-9-7-15(8-10-21)22-11-6-14-4-2-3-5-16(14)22/h2-6,11-12,15H,7-10H2,1H3,(H,19,20,23)
InChIKeyJMPQWEVNPCTAEW-UHFFFAOYSA-N
MW340.45 g/mol
LogP4.28
Rot. Bonds2

About 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide

4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide (PubChem CID 71657233) has the molecular formula C18H20N4OS and a molecular weight of 340.45 g/mol. Its IUPAC name is 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide
PubChem CID71657233
Molecular FormulaC18H20N4OS
Molecular Weight340.45 g/mol
Exact Mass340.14
IUPAC Name4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide
SMILESCc1csc(NC(=O)N2CCC(n3ccc4ccccc43)CC2)n1
InChIInChI=1S/C18H20N4OS/c1-13-12-24-17(19-13)20-18(23)21-9-7-15(8-10-21)22-11-6-14-4-2-3-5-16(14)22/h2-6,11-12,15H,7-10H2,1H3,(H,19,20,23)
InChIKeyJMPQWEVNPCTAEW-UHFFFAOYSA-N
XLogP4.28
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The IUPAC name of 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide (CID 71657233) is 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide is Cc1csc(NC(=O)N2CCC(n3ccc4ccccc43)CC2)n1.
What is the InChIKey of 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
The InChIKey is JMPQWEVNPCTAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4OS/c1-13-12-24-17(19-13)20-18(23)21-9-7-15(8-10-21)22-11-6-14-4-2-3-5-16(14)22/h2-6,11-12,15H,7-10H2,1H3,(H,19,20,23).
What are the key properties of 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide?
4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 4.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-indol-1-yl-N-(4-methyl-1,3-thiazol-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 71657233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).