N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide

C24H27N5O4 — CID 110151952

About N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide

N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide (PubChem CID 110151952) has the molecular formula C24H27N5O4 and a molecular weight of 449.51 g/mol. Its IUPAC name is N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide.

Molecular Properties

• Compound Name: N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide
• PubChem CID: 110151952
• Molecular Formula: C24H27N5O4
• Molecular Weight: 449.51 g/mol
• Exact Mass: 449.21
• IUPAC Name: N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide
• SMILES: Cc1nonc1COc1ccccc1C(=O)N1CCCC(C(=O)N(C)C)(c2ccccn2)C1
• InChI: InChI=1S/C24H27N5O4/c1-17-19(27-33-26-17)15-32-20-10-5-4-9-18(20)22(30)29-14-8-12-24(16-29,23(31)28(2)3)21-11-6-7-13-25-21/h4-7,9-11,13H,8,12,14-16H2,1-3H3
• InChIKey: GNBSSAALJYEEQK-UHFFFAOYSA-N
• XLogP: 2.61
• TPSA: 101.66 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	449.51
LogP ≤ 5	2.61
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide?

The IUPAC name of N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide (CID 110151952) is N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide.

What is the SMILES notation for N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide?

The canonical SMILES for N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide is Cc1nonc1COc1ccccc1C(=O)N1CCCC(C(=O)N(C)C)(c2ccccn2)C1.

What is the InChIKey of N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide?

The InChIKey is GNBSSAALJYEEQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N5O4/c1-17-19(27-33-26-17)15-32-20-10-5-4-9-18(20)22(30)29-14-8-12-24(16-29,23(31)28(2)3)21-11-6-7-13-25-21/h4-7,9-11,13H,8,12,14-16H2,1-3H3.

What are the key properties of N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide?

N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide has a molecular weight of 449.51 g/mol, XLogP of 2.61, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-dimethyl-1-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)methoxy]benzoyl]-3-pyridin-2-ylpiperidine-3-carboxamide is sourced from PubChem (CID 110151952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).