N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine

C30H50N4 — CID 146220761

IUPACN-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine
SMILESc1cn2cc(C3CCCCCCCCCCC3)nc(NCCC3CCCCCCCCC3)c2n1
InChIInChI=1S/C30H50N4/c1-2-7-11-15-19-27(20-16-12-8-3-1)28-25-34-24-23-32-30(34)29(33-28)31-22-21-26-17-13-9-5-4-6-10-14-18-26/h23-27H,1-22H2,(H,31,33)
InChIKeyIFVIWVKRCMGMGK-UHFFFAOYSA-N
MW466.76 g/mol
LogP9.06
Rot. Bonds5

About N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine

N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine (PubChem CID 146220761) has the molecular formula C30H50N4 and a molecular weight of 466.76 g/mol. Its IUPAC name is N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine
PubChem CID146220761
Molecular FormulaC30H50N4
Molecular Weight466.76 g/mol
Exact Mass466.40
IUPAC NameN-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine
SMILESc1cn2cc(C3CCCCCCCCCCC3)nc(NCCC3CCCCCCCCC3)c2n1
InChIInChI=1S/C30H50N4/c1-2-7-11-15-19-27(20-16-12-8-3-1)28-25-34-24-23-32-30(34)29(33-28)31-22-21-26-17-13-9-5-4-6-10-14-18-26/h23-27H,1-22H2,(H,31,33)
InChIKeyIFVIWVKRCMGMGK-UHFFFAOYSA-N
XLogP9.06
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500466.76
LogP ≤ 59.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine (CID 146220761) is N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine is c1cn2cc(C3CCCCCCCCCCC3)nc(NCCC3CCCCCCCCC3)c2n1.
What is the InChIKey of N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine?
The InChIKey is IFVIWVKRCMGMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H50N4/c1-2-7-11-15-19-27(20-16-12-8-3-1)28-25-34-24-23-32-30(34)29(33-28)31-22-21-26-17-13-9-5-4-6-10-14-18-26/h23-27H,1-22H2,(H,31,33).
What are the key properties of N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine?
N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine has a molecular weight of 466.76 g/mol, XLogP of 9.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclodecylethyl)-6-cyclododecylimidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 146220761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).