8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine

C13H21N5 — CID 80838339

IUPAC8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCC(C)CCC(C)Nc1nc(N)cn2ccnc12
InChIInChI=1S/C13H21N5/c1-9(2)4-5-10(3)16-12-13-15-6-7-18(13)8-11(14)17-12/h6-10H,4-5,14H2,1-3H3,(H,16,17)
InChIKeyGGKUFVIOFBNENU-UHFFFAOYSA-N
MW247.35 g/mol
LogP2.55
Rot. Bonds5

About 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine

8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 80838339) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID80838339
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
SMILESCC(C)CCC(C)Nc1nc(N)cn2ccnc12
InChIInChI=1S/C13H21N5/c1-9(2)4-5-10(3)16-12-13-15-6-7-18(13)8-11(14)17-12/h6-10H,4-5,14H2,1-3H3,(H,16,17)
InChIKeyGGKUFVIOFBNENU-UHFFFAOYSA-N
XLogP2.55
TPSA68.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-3-methylbutan-1-ol
CID 80848904
8-N-(1-methoxy-3-methylbutan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80841305
2-[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]-N-propylpropanamide
CID 80800872
8-(3-methylbutylsulfanyl)imidazo[1,2-a]pyrazin-6-amine
CID 107766025
8-N-(2-cyclopropylpropyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 113476564
6-hydrazinyl-N-(4-methoxybutan-2-yl)imidazo[1,2-a]pyrazin-8-amine
CID 80915322
8-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80807926
8-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 106390408
8-N-(3-ethylpentan-3-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80841859
8-N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]imidazo[1,2-a]pyrazine-6,8-diamine
CID 80848887
8-N-(2-ethylhexyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 107818998
3-[[(6-aminoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]hexan-1-ol
CID 106118645

Frequently Asked Questions

What is the IUPAC name of 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine (CID 80838339) is 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine is CC(C)CCC(C)Nc1nc(N)cn2ccnc12.
What is the InChIKey of 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is GGKUFVIOFBNENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-9(2)4-5-10(3)16-12-13-15-6-7-18(13)8-11(14)17-12/h6-10H,4-5,14H2,1-3H3,(H,16,17).
What are the key properties of 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 247.35 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 80838339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).