3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine

C17H21N7 — CID 143460538

IUPAC3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCNN(C)/C=C(\C)c1cnc2c(Nc3ccnc(C)c3)nccn12
InChIInChI=1S/C17H21N7/c1-12(11-23(4)18-3)15-10-21-17-16(20-7-8-24(15)17)22-14-5-6-19-13(2)9-14/h5-11,18H,1-4H3,(H,19,20,22)/b12-11+
InChIKeyYANCABRHGBELLS-VAWYXSNFSA-N
MW323.40 g/mol
LogP2.60
Rot. Bonds5

About 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine

3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 143460538) has the molecular formula C17H21N7 and a molecular weight of 323.40 g/mol. Its IUPAC name is 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID143460538
Molecular FormulaC17H21N7
Molecular Weight323.40 g/mol
Exact Mass323.19
IUPAC Name3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCNN(C)/C=C(\C)c1cnc2c(Nc3ccnc(C)c3)nccn12
InChIInChI=1S/C17H21N7/c1-12(11-23(4)18-3)15-10-21-17-16(20-7-8-24(15)17)22-14-5-6-19-13(2)9-14/h5-11,18H,1-4H3,(H,19,20,22)/b12-11+
InChIKeyYANCABRHGBELLS-VAWYXSNFSA-N
XLogP2.60
TPSA70.38 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(E)-1-[methyl-(methylideneamino)amino]prop-1-en-2-yl]-N-(2-prop-1-en-2-ylpyrazol-3-yl)imidazo[1,2-a]pyrazin-8-amine
CID 143461050
3-N-[3-[(2E,4E,7Z)-4-ethenyl-5-methylnona-2,4,7-trien-2-yl]imidazo[1,2-a]pyrazin-8-yl]-1-N-methylbenzene-1,3-diamine
CID 143464869
ethane;3-[(Z)-1-methylimino-1-(3-methylphenyl)but-2-en-2-yl]-N-[3-[methyl(methylamino)amino]phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 143460896
3-[(3Z)-3-(dimethylhydrazinylidene)prop-1-en-2-yl]-N-(3-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 143464743
1-N-imidazo[1,2-a]pyrazin-8-yl-3-N,3-N-dimethylbenzene-1,3-diamine;N-[3-[(Z)-2-methyl-3-[methyl(methylamino)amino]prop-2-enyl]phenyl]benzamide
CID 143460698
3-N-chloro-3-N-methyl-1-N-(3-thiophen-2-ylimidazo[1,2-a]pyrazin-8-yl)benzene-1,3-diamine
CID 143460922
methyl 8-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methylamino]imidazo[1,2-a]pyrazine-3-carboxylate
CID 155478844
3-N-[3-[(Z)-1-(3-aminophenyl)-1-ethyliminobut-2-en-2-yl]imidazo[1,2-a]pyrazin-8-yl]-1-N-ethylbenzene-1,3-diamine
CID 143756340
2-ethyl-N-propyl-4-[[3-[(Z)-5,5,5-trifluoro-4-methyliminopent-2-en-3-yl]imidazo[1,2-a]pyrazin-8-yl]amino]benzamide
CID 157025404
5-N-(2-methyl-4-pyridinyl)pyridine-2,5-diamine
CID 157043905
3-methyl-N-(3-methylphenyl)-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 58328545
4-N-[3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]-1-N-methylbenzene-1,4-diamine
CID 166890004

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine (CID 143460538) is 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine is CNN(C)/C=C(\C)c1cnc2c(Nc3ccnc(C)c3)nccn12.
What is the InChIKey of 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is YANCABRHGBELLS-VAWYXSNFSA-N. The full InChI is InChI=1S/C17H21N7/c1-12(11-23(4)18-3)15-10-21-17-16(20-7-8-24(15)17)22-14-5-6-19-13(2)9-14/h5-11,18H,1-4H3,(H,19,20,22)/b12-11+.
What are the key properties of 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine?
3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 323.40 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-1-[methyl(methylamino)amino]prop-1-en-2-yl]-N-(2-methyl-4-pyridinyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 143460538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).