5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine

C12H15ClN6 — CID 80831106

IUPAC5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine
SMILESCCNc1ncc(Cl)c(N2CCn3ccnc3C2)n1
InChIInChI=1S/C12H15ClN6/c1-2-14-12-16-7-9(13)11(17-12)19-6-5-18-4-3-15-10(18)8-19/h3-4,7H,2,5-6,8H2,1H3,(H,14,16,17)
InChIKeyRAHNJSLVCLSAFB-UHFFFAOYSA-N
MW278.75 g/mol
LogP1.78
Rot. Bonds3

About 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine

5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine (PubChem CID 80831106) has the molecular formula C12H15ClN6 and a molecular weight of 278.75 g/mol. Its IUPAC name is 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine.

Molecular Properties

Compound Name5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine
PubChem CID80831106
Molecular FormulaC12H15ClN6
Molecular Weight278.75 g/mol
Exact Mass278.10
IUPAC Name5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine
SMILESCCNc1ncc(Cl)c(N2CCn3ccnc3C2)n1
InChIInChI=1S/C12H15ClN6/c1-2-14-12-16-7-9(13)11(17-12)19-6-5-18-4-3-15-10(18)8-19/h3-4,7H,2,5-6,8H2,1H3,(H,14,16,17)
InChIKeyRAHNJSLVCLSAFB-UHFFFAOYSA-N
XLogP1.78
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.75
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine with MolForge

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Related Compounds

4-(4-tert-butylpiperazin-1-yl)-5-chloro-N-ethylpyrimidin-2-amine
CID 80796160
5-chloro-N-ethyl-4-piperazin-1-ylpyrimidin-2-amine
CID 80836911
5-chloro-N-ethyl-4-(4-methyl-1,4-diazepan-1-yl)pyrimidin-2-amine
CID 80766486
4-[5-chloro-2-(ethylamino)pyrimidin-4-yl]piperazine-2,6-dione
CID 80855498
3,5-dichloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-methylpyridin-2-amine
CID 102758125
7-(2-chloro-5-methylpyrimidin-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 79073104
5-chloro-4-(2,6-dimethylmorpholin-4-yl)-N-ethylpyrimidin-2-amine
CID 80764781
5-bromo-4-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine
CID 80843997
N-[[3-chloro-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-pyridinyl]methyl]ethanamine
CID 63026350
4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 103327562
7-(6-chloropyrazin-2-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 63027079
5-chloro-N-ethyl-4-(3-propoxypiperidin-1-yl)pyrimidin-2-amine
CID 80806982

Frequently Asked Questions

What is the IUPAC name of 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine?
The IUPAC name of 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine (CID 80831106) is 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine.
What is the SMILES notation for 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine?
The canonical SMILES for 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine is CCNc1ncc(Cl)c(N2CCn3ccnc3C2)n1.
What is the InChIKey of 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine?
The InChIKey is RAHNJSLVCLSAFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN6/c1-2-14-12-16-7-9(13)11(17-12)19-6-5-18-4-3-15-10(18)8-19/h3-4,7H,2,5-6,8H2,1H3,(H,14,16,17).
What are the key properties of 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine?
5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine has a molecular weight of 278.75 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-N-ethylpyrimidin-2-amine is sourced from PubChem (CID 80831106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).