N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide

C18H24N6O3 — CID 75447448

About N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide

N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide (PubChem CID 75447448) has the molecular formula C18H24N6O3 and a molecular weight of 372.43 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide.

Molecular Properties

• Compound Name: N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide
• PubChem CID: 75447448
• Molecular Formula: C18H24N6O3
• Molecular Weight: 372.43 g/mol
• Exact Mass: 372.19
• IUPAC Name: N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide
• SMILES: Cc1ccc(OC2CCN(C(=O)c3cn(CC(=O)N(C)C)nn3)CC2)nc1
• InChI: InChI=1S/C18H24N6O3/c1-13-4-5-16(19-10-13)27-14-6-8-23(9-7-14)18(26)15-11-24(21-20-15)12-17(25)22(2)3/h4-5,10-11,14H,6-9,12H2,1-3H3
• InChIKey: LRJSZPYVBFNEBV-UHFFFAOYSA-N
• XLogP: 0.75
• TPSA: 93.45 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.43
LogP ≤ 5	0.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide?

The IUPAC name of N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide (CID 75447448) is N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide.

What is the SMILES notation for N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide?

The canonical SMILES for N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide is Cc1ccc(OC2CCN(C(=O)c3cn(CC(=O)N(C)C)nn3)CC2)nc1.

What is the InChIKey of N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide?

The InChIKey is LRJSZPYVBFNEBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O3/c1-13-4-5-16(19-10-13)27-14-6-8-23(9-7-14)18(26)15-11-24(21-20-15)12-17(25)22(2)3/h4-5,10-11,14H,6-9,12H2,1-3H3.

What are the key properties of N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide?

N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide has a molecular weight of 372.43 g/mol, XLogP of 0.75, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-2-[4-[4-[(5-methyl-2-pyridinyl)oxy]piperidine-1-carbonyl]triazol-1-yl]acetamide is sourced from PubChem (CID 75447448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).