2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride

C14H25ClN4O2 — CID 119775640

About 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride

2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride (PubChem CID 119775640) has the molecular formula C14H25ClN4O2 and a molecular weight of 316.83 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride.

Molecular Properties

• Compound Name: 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride
• PubChem CID: 119775640
• Molecular Formula: C14H25ClN4O2
• Molecular Weight: 316.83 g/mol
• Exact Mass: 316.17
• IUPAC Name: 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride
• SMILES: CNCC(C)C(=O)N1CCCC(Cc2noc(C)n2)C1.Cl
• InChI: InChI=1S/C14H24N4O2.ClH/c1-10(8-15-3)14(19)18-6-4-5-12(9-18)7-13-16-11(2)20-17-13;/h10,12,15H,4-9H2,1-3H3;1H
• InChIKey: FQECXMVEWIUEBX-UHFFFAOYSA-N
• XLogP: 1.44
• TPSA: 71.26 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	316.83
LogP ≤ 5	1.44
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride?

The IUPAC name of 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride (CID 119775640) is 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride.

What is the SMILES notation for 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride?

The canonical SMILES for 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride is CNCC(C)C(=O)N1CCCC(Cc2noc(C)n2)C1.Cl.

What is the InChIKey of 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride?

The InChIKey is FQECXMVEWIUEBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2.ClH/c1-10(8-15-3)14(19)18-6-4-5-12(9-18)7-13-16-11(2)20-17-13;/h10,12,15H,4-9H2,1-3H3;1H.

What are the key properties of 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride?

2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride has a molecular weight of 316.83 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-3-(methylamino)-1-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-1-yl]propan-1-one;hydrochloride is sourced from PubChem (CID 119775640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).