(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate

C10H9BrN4O2 — CID 87313860

IUPAC(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate
SMILESO=C(NC1CC1)Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H9BrN4O2/c11-7-5-15-4-3-12-8(15)9(14-7)17-10(16)13-6-1-2-6/h3-6H,1-2H2,(H,13,16)
InChIKeyXFQJXRNYGKBBRB-UHFFFAOYSA-N
MW297.11 g/mol
LogP1.74
Rot. Bonds2

About (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate

(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate (PubChem CID 87313860) has the molecular formula C10H9BrN4O2 and a molecular weight of 297.11 g/mol. Its IUPAC name is (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate.

Molecular Properties

Compound Name(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate
PubChem CID87313860
Molecular FormulaC10H9BrN4O2
Molecular Weight297.11 g/mol
Exact Mass295.99
IUPAC Name(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate
SMILESO=C(NC1CC1)Oc1nc(Br)cn2ccnc12
InChIInChI=1S/C10H9BrN4O2/c11-7-5-15-4-3-12-8(15)9(14-7)17-10(16)13-6-1-2-6/h3-6H,1-2H2,(H,13,16)
InChIKeyXFQJXRNYGKBBRB-UHFFFAOYSA-N
XLogP1.74
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.11
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate?
The IUPAC name of (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate (CID 87313860) is (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate.
What is the SMILES notation for (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate?
The canonical SMILES for (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate is O=C(NC1CC1)Oc1nc(Br)cn2ccnc12.
What is the InChIKey of (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate?
The InChIKey is XFQJXRNYGKBBRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN4O2/c11-7-5-15-4-3-12-8(15)9(14-7)17-10(16)13-6-1-2-6/h3-6H,1-2H2,(H,13,16).
What are the key properties of (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate?
(6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate has a molecular weight of 297.11 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromoimidazo[1,2-a]pyrazin-8-yl) N-cyclopropylcarbamate is sourced from PubChem (CID 87313860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).