N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide

C20H32N6O — CID 60574355

About N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide

N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide (PubChem CID 60574355) has the molecular formula C20H32N6O and a molecular weight of 372.52 g/mol. Its IUPAC name is N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide.

Molecular Properties

• Compound Name: N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
• PubChem CID: 60574355
• Molecular Formula: C20H32N6O
• Molecular Weight: 372.52 g/mol
• Exact Mass: 372.26
• IUPAC Name: N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
• SMILES: Cc1nc2ncnn2c(C)c1CCC(=O)NC(C)CN1CC(C)CC(C)C1
• InChI: InChI=1S/C20H32N6O/c1-13-8-14(2)10-25(9-13)11-15(3)23-19(27)7-6-18-16(4)24-20-21-12-22-26(20)17(18)5/h12-15H,6-11H2,1-5H3,(H,23,27)
• InChIKey: DUPHAHABKSPTPF-UHFFFAOYSA-N
• XLogP: 2.16
• TPSA: 75.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.52
LogP ≤ 5	2.16
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide?

The IUPAC name of N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide (CID 60574355) is N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide.

What is the SMILES notation for N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide?

The canonical SMILES for N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide is Cc1nc2ncnn2c(C)c1CCC(=O)NC(C)CN1CC(C)CC(C)C1.

What is the InChIKey of N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide?

The InChIKey is DUPHAHABKSPTPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N6O/c1-13-8-14(2)10-25(9-13)11-15(3)23-19(27)7-6-18-16(4)24-20-21-12-22-26(20)17(18)5/h12-15H,6-11H2,1-5H3,(H,23,27).

What are the key properties of N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide?

N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide has a molecular weight of 372.52 g/mol, XLogP of 2.16, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(3,5-dimethylpiperidin-1-yl)propan-2-yl]-3-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide is sourced from PubChem (CID 60574355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).