4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile

C18H15N9 — CID 67433864

IUPAC4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile
SMILESCC(Nc1ncnc(N)c1C#N)c1nc2cnccn2c1-c1ccccn1
InChIInChI=1S/C18H15N9/c1-11(25-18-12(8-19)17(20)23-10-24-18)15-16(13-4-2-3-5-22-13)27-7-6-21-9-14(27)26-15/h2-7,9-11H,1H3,(H3,20,23,24,25)
InChIKeyAIMRHJZWXMUHNY-UHFFFAOYSA-N
MW357.38 g/mol
LogP2.21
Rot. Bonds4

About 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile

4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile (PubChem CID 67433864) has the molecular formula C18H15N9 and a molecular weight of 357.38 g/mol. Its IUPAC name is 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile.

Molecular Properties

Compound Name4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile
PubChem CID67433864
Molecular FormulaC18H15N9
Molecular Weight357.38 g/mol
Exact Mass357.15
IUPAC Name4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile
SMILESCC(Nc1ncnc(N)c1C#N)c1nc2cnccn2c1-c1ccccn1
InChIInChI=1S/C18H15N9/c1-11(25-18-12(8-19)17(20)23-10-24-18)15-16(13-4-2-3-5-22-13)27-7-6-21-9-14(27)26-15/h2-7,9-11H,1H3,(H3,20,23,24,25)
InChIKeyAIMRHJZWXMUHNY-UHFFFAOYSA-N
XLogP2.21
TPSA130.70 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.38
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

4-amino-6-[ethyl-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)amino]pyrimidine-5-carbonitrile
CID 67448956
4-amino-6-[1-(6-fluoro-4-pyridin-2-ylquinolin-3-yl)ethylamino]pyrimidine-5-carbonitrile
CID 67511449
4-amino-6-[[(1S)-1-[6-fluoro-1-(5-pyridin-2-yl-3-pyridinyl)benzimidazol-2-yl]ethyl]amino]pyrimidine-5-carbonitrile
CID 58459331
4-amino-6-[[(1R)-1-(4-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carbonitrile
CID 68910111
4-amino-6-[[(1R)-1-(6-fluoro-1-pyridin-2-ylbenzimidazol-2-yl)ethyl]amino]pyrimidine-5-carbonitrile
CID 58459373
4-amino-6-[[(1S)-1-[3-(3,5-difluorophenyl)imidazo[4,5-b]pyridin-2-yl]ethyl]amino]pyrimidine-5-carbonitrile
CID 58459371
4-amino-6-[[(1R)-1-[6-fluoro-1-(3-pyridin-2-ylphenyl)benzimidazol-2-yl]ethyl]amino]pyrimidine-5-carbonitrile;4-amino-6-[[(1S)-1-[6-fluoro-1-(3-pyridin-2-ylphenyl)benzimidazol-2-yl]ethyl]amino]pyrimidine-5-carbonitrile
CID 157168454
4-amino-6-[1-(2-phenylpyrido[4,3-e]thiazin-3-yl)ethylamino]pyrimidine-5-carbonitrile
CID 130338641
4-amino-6-[[(1S)-1-(6-fluoro-1-pyridin-3-ylbenzimidazol-2-yl)ethyl]amino]pyrimidine-5-carbonitrile
CID 58459229
4-amino-6-[1-(3-chloro-5-phenylpyrazolo[1,5-a]pyrimidin-6-yl)ethylamino]pyrimidine-5-carbonitrile
CID 139410772
4-amino-6-[1-(5-fluoro-1-pyridin-2-ylbenzimidazol-2-yl)ethylamino]pyrimidine-5-carbonitrile;4-amino-6-[1-(6-fluoro-1-pyridin-2-ylbenzimidazol-2-yl)ethylamino]pyrimidine-5-carbonitrile
CID 159749712
2-[1-[(6-amino-5-cyanopyrimidin-4-yl)amino]ethyl]-6-fluoro-N-(pyridin-2-ylmethyl)quinoline-3-carboxamide
CID 67124310

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile?
The IUPAC name of 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile (CID 67433864) is 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile.
What is the SMILES notation for 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile?
The canonical SMILES for 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile is CC(Nc1ncnc(N)c1C#N)c1nc2cnccn2c1-c1ccccn1.
What is the InChIKey of 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile?
The InChIKey is AIMRHJZWXMUHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N9/c1-11(25-18-12(8-19)17(20)23-10-24-18)15-16(13-4-2-3-5-22-13)27-7-6-21-9-14(27)26-15/h2-7,9-11H,1H3,(H3,20,23,24,25).
What are the key properties of 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile?
4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile has a molecular weight of 357.38 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-[1-(3-pyridin-2-ylimidazo[1,2-a]pyrazin-2-yl)ethylamino]pyrimidine-5-carbonitrile is sourced from PubChem (CID 67433864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).