7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride

C18H26Cl2N4 — CID 155837313

IUPAC7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride
SMILESCc1ccc(-c2cnc3n2CCN(C)C32CCNCC2)cc1.Cl.Cl
InChIInChI=1S/C18H24N4.2ClH/c1-14-3-5-15(6-4-14)16-13-20-17-18(7-9-19-10-8-18)21(2)11-12-22(16)17;;/h3-6,13,19H,7-12H2,1-2H3;2*1H
InChIKeyLEFZNEQYJCLTAF-UHFFFAOYSA-N
MW369.34 g/mol
LogP3.23
Rot. Bonds1

About 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride

7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride (PubChem CID 155837313) has the molecular formula C18H26Cl2N4 and a molecular weight of 369.34 g/mol. Its IUPAC name is 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride.

Molecular Properties

Compound Name7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride
PubChem CID155837313
Molecular FormulaC18H26Cl2N4
Molecular Weight369.34 g/mol
Exact Mass368.15
IUPAC Name7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride
SMILESCc1ccc(-c2cnc3n2CCN(C)C32CCNCC2)cc1.Cl.Cl
InChIInChI=1S/C18H24N4.2ClH/c1-14-3-5-15(6-4-14)16-13-20-17-18(7-9-19-10-8-18)21(2)11-12-22(16)17;;/h3-6,13,19H,7-12H2,1-2H3;2*1H
InChIKeyLEFZNEQYJCLTAF-UHFFFAOYSA-N
XLogP3.23
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.34
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride?
The IUPAC name of 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride (CID 155837313) is 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride.
What is the SMILES notation for 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride?
The canonical SMILES for 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride is Cc1ccc(-c2cnc3n2CCN(C)C32CCNCC2)cc1.Cl.Cl.
What is the InChIKey of 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride?
The InChIKey is LEFZNEQYJCLTAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4.2ClH/c1-14-3-5-15(6-4-14)16-13-20-17-18(7-9-19-10-8-18)21(2)11-12-22(16)17;;/h3-6,13,19H,7-12H2,1-2H3;2*1H.
What are the key properties of 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride?
7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride has a molecular weight of 369.34 g/mol, XLogP of 3.23, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(4-methylphenyl)spiro[5,6-dihydroimidazo[1,2-a]pyrazine-8,4'-piperidine];dihydrochloride is sourced from PubChem (CID 155837313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).