8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine

C16H23N5 — CID 80774654

IUPAC8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(N2CCC3CCCCC3C2)n1
InChIInChI=1S/C16H23N5/c1-17-14-11-21-9-7-18-15(21)16(19-14)20-8-6-12-4-2-3-5-13(12)10-20/h7,9,11-13,17H,2-6,8,10H2,1H3
InChIKeyAQBOTZOSCYDWER-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.79
Rot. Bonds2

About 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine

8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80774654) has the molecular formula C16H23N5 and a molecular weight of 285.39 g/mol. Its IUPAC name is 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80774654
Molecular FormulaC16H23N5
Molecular Weight285.39 g/mol
Exact Mass285.20
IUPAC Name8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
SMILESCNc1cn2ccnc2c(N2CCC3CCCCC3C2)n1
InChIInChI=1S/C16H23N5/c1-17-14-11-21-9-7-18-15(21)16(19-14)20-8-6-12-4-2-3-5-13(12)10-20/h7,9,11-13,17H,2-6,8,10H2,1H3
InChIKeyAQBOTZOSCYDWER-UHFFFAOYSA-N
XLogP2.79
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine with MolForge

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Related Compounds

N-methyl-8-(3-methylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 80797840
8-(4-methoxypiperidin-1-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
CID 80782616
8-(4,4-dimethylpiperidin-1-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
CID 80823258
1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide
CID 80754104
8-(2-ethylpiperidin-1-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
CID 80773843
8-(3-ethyl-4-methylpiperazin-1-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
CID 80833879
N-methyl-8-(2-propan-2-ylpyrrolidin-1-yl)imidazo[1,2-a]pyrazin-6-amine
CID 80855735
N-methyl-8-(1,4-thiazepan-4-yl)imidazo[1,2-a]pyrazin-6-amine
CID 80796047
8-(2,4-dimethylpiperidin-1-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine
CID 80826977
[8-(4-tert-butylpiperidin-1-yl)imidazo[1,2-a]pyrazin-6-yl]hydrazine
CID 80903209
1-[6-(ethylamino)imidazo[1,2-a]pyrazin-8-yl]piperidin-3-ol
CID 80778779
N-ethyl-8-[3-(methoxymethyl)pyrrolidin-1-yl]imidazo[1,2-a]pyrazin-6-amine
CID 80844191

Frequently Asked Questions

What is the IUPAC name of 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine (CID 80774654) is 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine is CNc1cn2ccnc2c(N2CCC3CCCCC3C2)n1.
What is the InChIKey of 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is AQBOTZOSCYDWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5/c1-17-14-11-21-9-7-18-15(21)16(19-14)20-8-6-12-4-2-3-5-13(12)10-20/h7,9,11-13,17H,2-6,8,10H2,1H3.
What are the key properties of 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine?
8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 285.39 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl)-N-methylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80774654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).