methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate

C15H24N4O2 — CID 79628708

IUPACmethyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate
SMILESCNC1(C(=O)OC)CCCC(N2CCn3ccnc3C2)C1
InChIInChI=1S/C15H24N4O2/c1-16-15(14(20)21-2)5-3-4-12(10-15)19-9-8-18-7-6-17-13(18)11-19/h6-7,12,16H,3-5,8-11H2,1-2H3
InChIKeyZNDAFBKKRICTLD-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.77
Rot. Bonds3

About methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate

methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate (PubChem CID 79628708) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate.

Molecular Properties

Compound Namemethyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate
PubChem CID79628708
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Namemethyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate
SMILESCNC1(C(=O)OC)CCCC(N2CCn3ccnc3C2)C1
InChIInChI=1S/C15H24N4O2/c1-16-15(14(20)21-2)5-3-4-12(10-15)19-9-8-18-7-6-17-13(18)11-19/h6-7,12,16H,3-5,8-11H2,1-2H3
InChIKeyZNDAFBKKRICTLD-UHFFFAOYSA-N
XLogP0.77
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate with MolForge

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Related Compounds

3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79651559
ethyl 1-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)cyclopentane-1-carboxylate
CID 79650847
[3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(ethylamino)cyclopentyl]methanol
CID 79655860
methyl 1-(methylamino)-3-(2-propan-2-ylimidazol-1-yl)cyclopentane-1-carboxylate
CID 79651528
methyl 3-(2,2-dimethylmorpholin-4-yl)-1-(methylamino)cyclohexane-1-carboxylate
CID 79641601
methyl 3-(8-azaspiro[4.5]decan-8-yl)-1-(methylamino)cyclopentane-1-carboxylate
CID 79644417
methyl 1-(methylamino)-3-(4-propan-2-ylpiperazin-1-yl)cyclopentane-1-carboxylate
CID 79655269
methyl 3-(2-ethylpiperidin-1-yl)-1-(methylamino)cyclohexane-1-carboxylate
CID 79636980
ethyl 1-(methylamino)-3-(4-methylpiperazin-1-yl)cyclohexane-1-carboxylate
CID 79636962
1-(methylamino)-3-(2-propan-2-ylimidazol-1-yl)cyclohexane-1-carboxylic acid
CID 79641596
methyl 6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxylate
CID 110712648
methyl 1-(methylamino)-3-(2-propylpiperidin-1-yl)cyclohexane-1-carboxylate
CID 83044318

Frequently Asked Questions

What is the IUPAC name of methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate?
The IUPAC name of methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate (CID 79628708) is methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate.
What is the SMILES notation for methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate?
The canonical SMILES for methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate is CNC1(C(=O)OC)CCCC(N2CCn3ccnc3C2)C1.
What is the InChIKey of methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate?
The InChIKey is ZNDAFBKKRICTLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-16-15(14(20)21-2)5-3-4-12(10-15)19-9-8-18-7-6-17-13(18)11-19/h6-7,12,16H,3-5,8-11H2,1-2H3.
What are the key properties of methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate?
methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate has a molecular weight of 292.38 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(methylamino)cyclohexane-1-carboxylate is sourced from PubChem (CID 79628708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).