3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine

C11H17N5 — CID 904580

IUPAC3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine
SMILESCc1nc2nc(NC(C)C)n(C)c2nc1C
InChIInChI=1S/C11H17N5/c1-6(2)12-11-15-9-10(16(11)5)14-8(4)7(3)13-9/h6H,1-5H3,(H,12,13,15)
InChIKeyHRDXPGWWTLYRTB-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.80
Rot. Bonds2

About 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine

3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine (PubChem CID 904580) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine.

Molecular Properties

Compound Name3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine
PubChem CID904580
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine
SMILESCc1nc2nc(NC(C)C)n(C)c2nc1C
InChIInChI=1S/C11H17N5/c1-6(2)12-11-15-9-10(16(11)5)14-8(4)7(3)13-9/h6H,1-5H3,(H,12,13,15)
InChIKeyHRDXPGWWTLYRTB-UHFFFAOYSA-N
XLogP1.80
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine?
The IUPAC name of 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine (CID 904580) is 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine.
What is the SMILES notation for 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine?
The canonical SMILES for 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine is Cc1nc2nc(NC(C)C)n(C)c2nc1C.
What is the InChIKey of 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine?
The InChIKey is HRDXPGWWTLYRTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-6(2)12-11-15-9-10(16(11)5)14-8(4)7(3)13-9/h6H,1-5H3,(H,12,13,15).
What are the key properties of 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine?
3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine has a molecular weight of 219.29 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,6-trimethyl-N-propan-2-ylimidazo[4,5-b]pyrazin-2-amine is sourced from PubChem (CID 904580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).