N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine

C20H33N5 — CID 143187075

About N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine

N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine (PubChem CID 143187075) has the molecular formula C20H33N5 and a molecular weight of 343.52 g/mol. Its IUPAC name is N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine.

Molecular Properties

• Compound Name: N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
• PubChem CID: 143187075
• Molecular Formula: C20H33N5
• Molecular Weight: 343.52 g/mol
• Exact Mass: 343.27
• IUPAC Name: N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
• SMILES: CCC(CNC)CN1CCN=C1CN(C)C1CCCc2cccnc21
• InChI: InChI=1S/C20H33N5/c1-4-16(13-21-2)14-25-12-11-22-19(25)15-24(3)18-9-5-7-17-8-6-10-23-20(17)18/h6,8,10,16,18,21H,4-5,7,9,11-15H2,1-3H3
• InChIKey: DXHYHSIWAWWVGX-UHFFFAOYSA-N
• XLogP: 2.35
• TPSA: 43.76 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	343.52
LogP ≤ 5	2.35
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?

The IUPAC name of N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine (CID 143187075) is N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine.

What is the SMILES notation for N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?

The canonical SMILES for N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine is CCC(CNC)CN1CCN=C1CN(C)C1CCCc2cccnc21.

What is the InChIKey of N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?

The InChIKey is DXHYHSIWAWWVGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N5/c1-4-16(13-21-2)14-25-12-11-22-19(25)15-24(3)18-9-5-7-17-8-6-10-23-20(17)18/h6,8,10,16,18,21H,4-5,7,9,11-15H2,1-3H3.

What are the key properties of N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?

N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine has a molecular weight of 343.52 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-methyl-N-[[1-[2-(methylaminomethyl)butyl]-4,5-dihydroimidazol-2-yl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine is sourced from PubChem (CID 143187075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).