N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide

C15H19N5O2S — CID 154736095

IUPACN-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
SMILESCc1nc(NC(=O)C2CCCCN2C(=O)c2cccs2)nn1C
InChIInChI=1S/C15H19N5O2S/c1-10-16-15(18-19(10)2)17-13(21)11-6-3-4-8-20(11)14(22)12-7-5-9-23-12/h5,7,9,11H,3-4,6,8H2,1-2H3,(H,17,18,21)
InChIKeyFPOAGGKXEATJJN-UHFFFAOYSA-N
MW333.42 g/mol
LogP1.82
Rot. Bonds3

About N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide

N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide (PubChem CID 154736095) has the molecular formula C15H19N5O2S and a molecular weight of 333.42 g/mol. Its IUPAC name is N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
PubChem CID154736095
Molecular FormulaC15H19N5O2S
Molecular Weight333.42 g/mol
Exact Mass333.13
IUPAC NameN-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
SMILESCc1nc(NC(=O)C2CCCCN2C(=O)c2cccs2)nn1C
InChIInChI=1S/C15H19N5O2S/c1-10-16-15(18-19(10)2)17-13(21)11-6-3-4-8-20(11)14(22)12-7-5-9-23-12/h5,7,9,11H,3-4,6,8H2,1-2H3,(H,17,18,21)
InChIKeyFPOAGGKXEATJJN-UHFFFAOYSA-N
XLogP1.82
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.42
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-acetamidophenyl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 18225954
N-(4-methoxyphenyl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 78844859
N-[4-(methylcarbamoylamino)phenyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 86922399
N-[4-(propanoylamino)phenyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 78887255
(2R)-N-[4-(phenylcarbamoylamino)phenyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 32953422
N-(1,3-thiazol-2-yl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 4883035
(2S)-N-(3,4-dimethylphenyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 1203465
N-(5-bromo-2-pyridinyl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 78844765
(2S)-N-[(2-methylpyrimidin-4-yl)methyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 124626241
N-[2-methyl-3-(methylcarbamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide
CID 86983132
(2R)-N-(4-methyl-1,3-benzothiazol-2-yl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide
CID 2650203
2-[[1-(thiophene-2-carbonyl)piperidine-2-carbonyl]amino]propanoic acid
CID 119348963

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide?
The IUPAC name of N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide (CID 154736095) is N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide?
The canonical SMILES for N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide is Cc1nc(NC(=O)C2CCCCN2C(=O)c2cccs2)nn1C.
What is the InChIKey of N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide?
The InChIKey is FPOAGGKXEATJJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O2S/c1-10-16-15(18-19(10)2)17-13(21)11-6-3-4-8-20(11)14(22)12-7-5-9-23-12/h5,7,9,11H,3-4,6,8H2,1-2H3,(H,17,18,21).
What are the key properties of N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide?
N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide has a molecular weight of 333.42 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethyl-1,2,4-triazol-3-yl)-1-(thiophene-2-carbonyl)piperidine-2-carboxamide is sourced from PubChem (CID 154736095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).