2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide

C12H14N4O — CID 146065629

IUPAC2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide
SMILESNC(=O)CN1CCn2c(nc3ccccc32)C1
InChIInChI=1S/C12H14N4O/c13-11(17)7-15-5-6-16-10-4-2-1-3-9(10)14-12(16)8-15/h1-4H,5-8H2,(H2,13,17)
InChIKeyKQXPXYLIUXMDHM-UHFFFAOYSA-N
MW230.27 g/mol
LogP0.34
Rot. Bonds2

About 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide

2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide (PubChem CID 146065629) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide
PubChem CID146065629
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide
SMILESNC(=O)CN1CCn2c(nc3ccccc32)C1
InChIInChI=1S/C12H14N4O/c13-11(17)7-15-5-6-16-10-4-2-1-3-9(10)14-12(16)8-15/h1-4H,5-8H2,(H2,13,17)
InChIKeyKQXPXYLIUXMDHM-UHFFFAOYSA-N
XLogP0.34
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)-2-phenylethanone
CID 110872437
2-(4-chlorophenyl)-1-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)ethanone
CID 110872438
2-[3-(4-bromophenyl)sulfanylpropyl]-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole
CID 162677102
3-(benzenesulfonyl)-1-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)propan-1-one
CID 20866205
N-(4-fluorophenyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole-2-carboxamide
CID 3238265
2-propylsulfonyl-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole
CID 5308283
2-(oxolan-2-ylmethyl)-3,4-dihydro-1H-pyrazino[1,2-a]benzimidazole-8-carboxamide
CID 42651710
3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl-(3,5-dimethoxyphenyl)methanone
CID 110867060
2-[4-(2-indol-1-ylacetyl)piperazin-1-yl]acetamide
CID 86822734
3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl-(3-methoxyphenyl)methanone
CID 110872433
1-[3-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)phenyl]-3-phenylurea
CID 46268832
N-[4-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)phenyl]-3-phenylpropanamide
CID 46268807

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide?
The IUPAC name of 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide (CID 146065629) is 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide.
What is the SMILES notation for 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide?
The canonical SMILES for 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide is NC(=O)CN1CCn2c(nc3ccccc32)C1.
What is the InChIKey of 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide?
The InChIKey is KQXPXYLIUXMDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c13-11(17)7-15-5-6-16-10-4-2-1-3-9(10)14-12(16)8-15/h1-4H,5-8H2,(H2,13,17).
What are the key properties of 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide?
2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide has a molecular weight of 230.27 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dihydro-1H-pyrazino[1,2-a]benzimidazol-2-yl)acetamide is sourced from PubChem (CID 146065629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).