1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine

C16H18N4O — CID 164696378

IUPAC1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine
SMILESCOc1nccn2c(-c3ccc(CN(C)C)cc3)cnc12
InChIInChI=1S/C16H18N4O/c1-19(2)11-12-4-6-13(7-5-12)14-10-18-15-16(21-3)17-8-9-20(14)15/h4-10H,11H2,1-3H3
InChIKeyOQHKXJCLKTVZHE-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.47
Rot. Bonds4

About 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine

1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine (PubChem CID 164696378) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine
PubChem CID164696378
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine
SMILESCOc1nccn2c(-c3ccc(CN(C)C)cc3)cnc12
InChIInChI=1S/C16H18N4O/c1-19(2)11-12-4-6-13(7-5-12)14-10-18-15-16(21-3)17-8-9-20(14)15/h4-10H,11H2,1-3H3
InChIKeyOQHKXJCLKTVZHE-UHFFFAOYSA-N
XLogP2.47
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine (CID 164696378) is 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine is COc1nccn2c(-c3ccc(CN(C)C)cc3)cnc12.
What is the InChIKey of 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine?
The InChIKey is OQHKXJCLKTVZHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-19(2)11-12-4-6-13(7-5-12)14-10-18-15-16(21-3)17-8-9-20(14)15/h4-10H,11H2,1-3H3.
What are the key properties of 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine?
1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine has a molecular weight of 282.35 g/mol, XLogP of 2.47, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(8-methoxyimidazo[1,2-a]pyrazin-3-yl)phenyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 164696378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).