6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine

C14H19BrN4O — CID 79958355

IUPAC6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOCCN(c1nc(Br)cn2ccnc12)C(C)C1CC1
InChIInChI=1S/C14H19BrN4O/c1-10(11-3-4-11)19(7-8-20-2)14-13-16-5-6-18(13)9-12(15)17-14/h5-6,9-11H,3-4,7-8H2,1-2H3
InChIKeyPVYOMFDAOPWNFD-UHFFFAOYSA-N
MW339.24 g/mol
LogP2.74
Rot. Bonds6

About 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine

6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 79958355) has the molecular formula C14H19BrN4O and a molecular weight of 339.24 g/mol. Its IUPAC name is 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID79958355
Molecular FormulaC14H19BrN4O
Molecular Weight339.24 g/mol
Exact Mass338.07
IUPAC Name6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESCOCCN(c1nc(Br)cn2ccnc12)C(C)C1CC1
InChIInChI=1S/C14H19BrN4O/c1-10(11-3-4-11)19(7-8-20-2)14-13-16-5-6-18(13)9-12(15)17-14/h5-6,9-11H,3-4,7-8H2,1-2H3
InChIKeyPVYOMFDAOPWNFD-UHFFFAOYSA-N
XLogP2.74
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.24
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine (CID 79958355) is 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine is COCCN(c1nc(Br)cn2ccnc12)C(C)C1CC1.
What is the InChIKey of 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is PVYOMFDAOPWNFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN4O/c1-10(11-3-4-11)19(7-8-20-2)14-13-16-5-6-18(13)9-12(15)17-14/h5-6,9-11H,3-4,7-8H2,1-2H3.
What are the key properties of 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine?
6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 339.24 g/mol, XLogP of 2.74, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(1-cyclopropylethyl)-N-(2-methoxyethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 79958355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).