(2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

C13H14N4O — CID 63015477

IUPAC(2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESNc1ccccc1C(=O)N1CCn2ccnc2C1
InChIInChI=1S/C13H14N4O/c14-11-4-2-1-3-10(11)13(18)17-8-7-16-6-5-15-12(16)9-17/h1-6H,7-9,14H2
InChIKeyIDVFVNODCNCVKA-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.12
Rot. Bonds1

About (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone

(2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (PubChem CID 63015477) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.

Molecular Properties

Compound Name(2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
PubChem CID63015477
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name(2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
SMILESNc1ccccc1C(=O)N1CCn2ccnc2C1
InChIInChI=1S/C13H14N4O/c14-11-4-2-1-3-10(11)13(18)17-8-7-16-6-5-15-12(16)9-17/h1-6H,7-9,14H2
InChIKeyIDVFVNODCNCVKA-UHFFFAOYSA-N
XLogP1.12
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(2-methoxyphenyl)methanone
CID 110712610
(2-amino-6-methylphenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 63013707
(2,4-dibromophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 103882843
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(2,6-dihydroxyphenyl)methanone
CID 103890482
(2-amino-6-ethoxyphenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 81394683
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(4-hydrazinyl-3-pyridinyl)methanone
CID 81255607
(4-bromo-2-fluorophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 63025085
(4-chloro-2-hydroxyphenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 63026132
(5-bromofuran-2-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 55143260
2-bromo-1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanone
CID 63680123
6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl-(3,5-dihydroxyphenyl)methanone
CID 104939006
(6-chloropyridazin-3-yl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone
CID 63014872

Frequently Asked Questions

What is the IUPAC name of (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The IUPAC name of (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone (CID 63015477) is (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone.
What is the SMILES notation for (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The canonical SMILES for (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is Nc1ccccc1C(=O)N1CCn2ccnc2C1.
What is the InChIKey of (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
The InChIKey is IDVFVNODCNCVKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c14-11-4-2-1-3-10(11)13(18)17-8-7-16-6-5-15-12(16)9-17/h1-6H,7-9,14H2.
What are the key properties of (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone?
(2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone has a molecular weight of 242.28 g/mol, XLogP of 1.12, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminophenyl)-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)methanone is sourced from PubChem (CID 63015477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).