[6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine

C9H11BrN4O — CID 10214701

IUPAC[6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine
SMILESCOCc1cnc2c(CN)nc(Br)cn12
InChIInChI=1S/C9H11BrN4O/c1-15-5-6-3-12-9-7(2-11)13-8(10)4-14(6)9/h3-4H,2,5,11H2,1H3
InChIKeyYYGYPHWBWKGUJZ-UHFFFAOYSA-N
MW271.12 g/mol
LogP1.10
Rot. Bonds3

About [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine

[6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine (PubChem CID 10214701) has the molecular formula C9H11BrN4O and a molecular weight of 271.12 g/mol. Its IUPAC name is [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine.

Molecular Properties

Compound Name[6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine
PubChem CID10214701
Molecular FormulaC9H11BrN4O
Molecular Weight271.12 g/mol
Exact Mass270.01
IUPAC Name[6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine
SMILESCOCc1cnc2c(CN)nc(Br)cn12
InChIInChI=1S/C9H11BrN4O/c1-15-5-6-3-12-9-7(2-11)13-8(10)4-14(6)9/h3-4H,2,5,11H2,1H3
InChIKeyYYGYPHWBWKGUJZ-UHFFFAOYSA-N
XLogP1.10
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.12
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine?
The IUPAC name of [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine (CID 10214701) is [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine.
What is the SMILES notation for [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine?
The canonical SMILES for [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine is COCc1cnc2c(CN)nc(Br)cn12.
What is the InChIKey of [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine?
The InChIKey is YYGYPHWBWKGUJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN4O/c1-15-5-6-3-12-9-7(2-11)13-8(10)4-14(6)9/h3-4H,2,5,11H2,1H3.
What are the key properties of [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine?
[6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine has a molecular weight of 271.12 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-bromo-3-(methoxymethyl)imidazo[1,2-a]pyrazin-8-yl]methanamine is sourced from PubChem (CID 10214701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).