3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide

C15H23N7O2 — CID 132971404

IUPAC3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide
SMILESCc1nc(CC2CCCN(C(=O)NCCCn3ccnn3)C2)no1
InChIInChI=1S/C15H23N7O2/c1-12-18-14(19-24-12)10-13-4-2-7-21(11-13)15(23)16-5-3-8-22-9-6-17-20-22/h6,9,13H,2-5,7-8,10-11H2,1H3,(H,16,23)
InChIKeyLSSJMUFDVWNGEK-UHFFFAOYSA-N
MW333.40 g/mol
LogP1.02
Rot. Bonds6

About 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide

3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide (PubChem CID 132971404) has the molecular formula C15H23N7O2 and a molecular weight of 333.40 g/mol. Its IUPAC name is 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide
PubChem CID132971404
Molecular FormulaC15H23N7O2
Molecular Weight333.40 g/mol
Exact Mass333.19
IUPAC Name3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide
SMILESCc1nc(CC2CCCN(C(=O)NCCCn3ccnn3)C2)no1
InChIInChI=1S/C15H23N7O2/c1-12-18-14(19-24-12)10-13-4-2-7-21(11-13)15(23)16-5-3-8-22-9-6-17-20-22/h6,9,13H,2-5,7-8,10-11H2,1H3,(H,16,23)
InChIKeyLSSJMUFDVWNGEK-UHFFFAOYSA-N
XLogP1.02
TPSA101.97 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]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

Related Compounds

(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-prop-2-enylpiperidine-1-carboxamide
CID 97074173
2-[1-[3-(triazol-1-yl)propylcarbamoyl]azetidin-3-yl]acetic acid
CID 113413120
3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-(1-pyridin-4-ylpropyl)piperidine-1-carboxamide
CID 136529525
(3R)-N-(5-fluoro-2-pyridinyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide
CID 99597501
(3R)-1-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethylcarbamoyl]piperidine-3-carboxylic acid
CID 106420517
1-acetyl-N-[3-(triazol-1-yl)propyl]piperidine-3-carboxamide
CID 72883089
(3R)-3-(1H-benzimidazol-2-ylmethyl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide
CID 125444272
3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[(1R,2S)-2-phenylcyclopropyl]piperidine-1-carboxamide
CID 122130973
2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride
CID 119775640
(3S)-N-(2-methoxy-6-methylphenyl)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carboxamide
CID 124628067
2-(1-aminocyclobutyl)-1-[(3R)-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]ethanone
CID 124697978
4-amino-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]pentan-1-one
CID 120562335

Frequently Asked Questions

What is the IUPAC name of 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide?
The IUPAC name of 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide (CID 132971404) is 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide?
The canonical SMILES for 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide is Cc1nc(CC2CCCN(C(=O)NCCCn3ccnn3)C2)no1.
What is the InChIKey of 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide?
The InChIKey is LSSJMUFDVWNGEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N7O2/c1-12-18-14(19-24-12)10-13-4-2-7-21(11-13)15(23)16-5-3-8-22-9-6-17-20-22/h6,9,13H,2-5,7-8,10-11H2,1H3,(H,16,23).
What are the key properties of 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide?
3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide has a molecular weight of 333.40 g/mol, XLogP of 1.02, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-[3-(triazol-1-yl)propyl]piperidine-1-carboxamide is sourced from PubChem (CID 132971404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).