6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine

C13H16BrN5 — CID 79947242

IUPAC6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESBrc1cn2ccnc2c(NC2CCN(C3CC3)C2)n1
InChIInChI=1S/C13H16BrN5/c14-11-8-19-6-4-15-13(19)12(17-11)16-9-3-5-18(7-9)10-1-2-10/h4,6,8-10H,1-3,5,7H2,(H,16,17)
InChIKeyRSSWWQFOPLIUHA-UHFFFAOYSA-N
MW322.21 g/mol
LogP2.14
Rot. Bonds3

About 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine

6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 79947242) has the molecular formula C13H16BrN5 and a molecular weight of 322.21 g/mol. Its IUPAC name is 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID79947242
Molecular FormulaC13H16BrN5
Molecular Weight322.21 g/mol
Exact Mass321.06
IUPAC Name6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESBrc1cn2ccnc2c(NC2CCN(C3CC3)C2)n1
InChIInChI=1S/C13H16BrN5/c14-11-8-19-6-4-15-13(19)12(17-11)16-9-3-5-18(7-9)10-1-2-10/h4,6,8-10H,1-3,5,7H2,(H,16,17)
InChIKeyRSSWWQFOPLIUHA-UHFFFAOYSA-N
XLogP2.14
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.21
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine (CID 79947242) is 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine is Brc1cn2ccnc2c(NC2CCN(C3CC3)C2)n1.
What is the InChIKey of 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is RSSWWQFOPLIUHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16BrN5/c14-11-8-19-6-4-15-13(19)12(17-11)16-9-3-5-18(7-9)10-1-2-10/h4,6,8-10H,1-3,5,7H2,(H,16,17).
What are the key properties of 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine?
6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 322.21 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(1-cyclopropylpyrrolidin-3-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 79947242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).