3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine

C17H14N4O — CID 164609276

IUPAC3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine
SMILESCOc1cccc(-c2cn3c(nc4ccccc43)c(N)n2)c1
InChIInChI=1S/C17H14N4O/c1-22-12-6-4-5-11(9-12)14-10-21-15-8-3-2-7-13(15)20-17(21)16(18)19-14/h2-10H,1H3,(H2,18,19)
InChIKeyZUWANJQWYNUYFR-UHFFFAOYSA-N
MW290.33 g/mol
LogP3.14
Rot. Bonds2

About 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine

3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine (PubChem CID 164609276) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine.

Molecular Properties

Compound Name3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine
PubChem CID164609276
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine
SMILESCOc1cccc(-c2cn3c(nc4ccccc43)c(N)n2)c1
InChIInChI=1S/C17H14N4O/c1-22-12-6-4-5-11(9-12)14-10-21-15-8-3-2-7-13(15)20-17(21)16(18)19-14/h2-10H,1H3,(H2,18,19)
InChIKeyZUWANJQWYNUYFR-UHFFFAOYSA-N
XLogP3.14
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenyl)imidazo[1,2-a]quinoxalin-4-amine
CID 25253879
4-methoxy-2-(4-methoxyphenyl)imidazo[1,2-a]quinoxaline
CID 67547841
1-(4-methoxyphenyl)-3-(4-methylphenyl)pyrazino[1,2-a]benzimidazole
CID 51032413
6-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-amine
CID 82479019
4-(3-methoxyphenyl)pyridine-2,6-diamine
CID 18313645
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
2-methoxybenzimidazolo[2,1-a]isoquinoline
CID 134847544
2-(3-methoxyphenyl)-1-pentylbenzimidazole
CID 17001673
N'-[2-(2,4-dimethoxyphenyl)imidazo[1,2-a]quinoxalin-4-yl]ethane-1,2-diamine
CID 67545807
4-(3-methoxyphenyl)-1-pentylimidazol-2-amine
CID 162671245
1-(4-chlorophenyl)-2-(3-methoxyphenyl)benzimidazole
CID 134816857
1-butyl-2-(3-methoxyphenyl)benzimidazole
CID 17001670

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine?
The IUPAC name of 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine (CID 164609276) is 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine.
What is the SMILES notation for 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine?
The canonical SMILES for 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine is COc1cccc(-c2cn3c(nc4ccccc43)c(N)n2)c1.
What is the InChIKey of 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine?
The InChIKey is ZUWANJQWYNUYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-22-12-6-4-5-11(9-12)14-10-21-15-8-3-2-7-13(15)20-17(21)16(18)19-14/h2-10H,1H3,(H2,18,19).
What are the key properties of 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine?
3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine has a molecular weight of 290.33 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyphenyl)pyrazino[1,2-a]benzimidazol-1-amine is sourced from PubChem (CID 164609276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).