8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine

C16H25N5 — CID 107403167

IUPAC8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCCNc1cn2ccnc2c(N(CC)CC2CCC2)n1
InChIInChI=1S/C16H25N5/c1-3-8-17-14-12-21-10-9-18-15(21)16(19-14)20(4-2)11-13-6-5-7-13/h9-10,12-13,17H,3-8,11H2,1-2H3
InChIKeyDGTVIRFSTBGBSU-UHFFFAOYSA-N
MW287.41 g/mol
LogP3.18
Rot. Bonds7

About 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine

8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine (PubChem CID 107403167) has the molecular formula C16H25N5 and a molecular weight of 287.41 g/mol. Its IUPAC name is 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine.

Molecular Properties

Compound Name8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
PubChem CID107403167
Molecular FormulaC16H25N5
Molecular Weight287.41 g/mol
Exact Mass287.21
IUPAC Name8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
SMILESCCCNc1cn2ccnc2c(N(CC)CC2CCC2)n1
InChIInChI=1S/C16H25N5/c1-3-8-17-14-12-21-10-9-18-15(21)16(19-14)20(4-2)11-13-6-5-7-13/h9-10,12-13,17H,3-8,11H2,1-2H3
InChIKeyDGTVIRFSTBGBSU-UHFFFAOYSA-N
XLogP3.18
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
The IUPAC name of 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine (CID 107403167) is 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine.
What is the SMILES notation for 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
The canonical SMILES for 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine is CCCNc1cn2ccnc2c(N(CC)CC2CCC2)n1.
What is the InChIKey of 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
The InChIKey is DGTVIRFSTBGBSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5/c1-3-8-17-14-12-21-10-9-18-15(21)16(19-14)20(4-2)11-13-6-5-7-13/h9-10,12-13,17H,3-8,11H2,1-2H3.
What are the key properties of 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine?
8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine has a molecular weight of 287.41 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N-(cyclobutylmethyl)-8-N-ethyl-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine is sourced from PubChem (CID 107403167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).