8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine

C14H16N6 — CID 80788971

IUPAC8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCN(C)c1ccc(Nc2nc(N)cn3ccnc23)cc1
InChIInChI=1S/C14H16N6/c1-19(2)11-5-3-10(4-6-11)17-13-14-16-7-8-20(14)9-12(15)18-13/h3-9H,15H2,1-2H3,(H,17,18)
InChIKeyTYPOHAXKPKZTOU-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.12
Rot. Bonds3

About 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine

8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80788971) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80788971
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC Name8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCN(C)c1ccc(Nc2nc(N)cn3ccnc23)cc1
InChIInChI=1S/C14H16N6/c1-19(2)11-5-3-10(4-6-11)17-13-14-16-7-8-20(14)9-12(15)18-13/h3-9H,15H2,1-2H3,(H,17,18)
InChIKeyTYPOHAXKPKZTOU-UHFFFAOYSA-N
XLogP2.12
TPSA71.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine (CID 80788971) is 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine is CN(C)c1ccc(Nc2nc(N)cn3ccnc23)cc1.
What is the InChIKey of 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is TYPOHAXKPKZTOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-19(2)11-5-3-10(4-6-11)17-13-14-16-7-8-20(14)9-12(15)18-13/h3-9H,15H2,1-2H3,(H,17,18).
What are the key properties of 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 268.32 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80788971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).