6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine

C10H8BrN3O — CID 106794873

IUPAC6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine
SMILESC#CCCOc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H8BrN3O/c1-2-3-6-15-10-9-12-4-5-14(9)7-8(11)13-10/h1,4-5,7H,3,6H2
InChIKeyUNGZUSARWHVTDN-UHFFFAOYSA-N
MW266.10 g/mol
LogP1.89
Rot. Bonds3

About 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine

6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine (PubChem CID 106794873) has the molecular formula C10H8BrN3O and a molecular weight of 266.10 g/mol. Its IUPAC name is 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine
PubChem CID106794873
Molecular FormulaC10H8BrN3O
Molecular Weight266.10 g/mol
Exact Mass264.99
IUPAC Name6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine
SMILESC#CCCOc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H8BrN3O/c1-2-3-6-15-10-9-12-4-5-14(9)7-8(11)13-10/h1,4-5,7H,3,6H2
InChIKeyUNGZUSARWHVTDN-UHFFFAOYSA-N
XLogP1.89
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.10
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

6-bromo-8-but-3-enoxyimidazo[1,2-a]pyrazine
CID 79956193
N-[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyethyl]-N-propan-2-ylpropan-2-amine
CID 115505455
6-bromo-8-propan-2-yloxyimidazo[1,2-a]pyrazine
CID 79956015
4-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxybenzonitrile
CID 79955212
6-bromo-8-(2,3-dichlorophenoxy)imidazo[1,2-a]pyrazine
CID 79956196
[2-(6-bromoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
CID 79955672
8-(3,3-dimethylbutoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80878142
6-bromo-8-[(5-methyl-1H-pyrazol-3-yl)oxy]imidazo[1,2-a]pyrazine
CID 81342308
6-bromo-8-(2-propan-2-ylphenoxy)imidazo[1,2-a]pyrazine
CID 79955847
(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate
CID 87313860
6-bromo-N,N-diethylimidazo[1,2-a]pyrazin-8-amine
CID 79955501
6-bromo-N-ethyl-N-methylimidazo[1,2-a]pyrazin-8-amine
CID 79955430

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine?
The IUPAC name of 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine (CID 106794873) is 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine.
What is the SMILES notation for 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine?
The canonical SMILES for 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine is C#CCCOc1nc(Br)cn2ccnc12.
What is the InChIKey of 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine?
The InChIKey is UNGZUSARWHVTDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3O/c1-2-3-6-15-10-9-12-4-5-14(9)7-8(11)13-10/h1,4-5,7H,3,6H2.
What are the key properties of 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine?
6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine has a molecular weight of 266.10 g/mol, XLogP of 1.89, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-but-3-ynoxyimidazo[1,2-a]pyrazine is sourced from PubChem (CID 106794873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).