6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine

C16H17BrN4 — CID 79954125

IUPAC6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCC(CCc1ccccc1)Nc1nc(Br)cn2ccnc12
InChIInChI=1S/C16H17BrN4/c1-12(7-8-13-5-3-2-4-6-13)19-15-16-18-9-10-21(16)11-14(17)20-15/h2-6,9-12H,7-8H2,1H3,(H,19,20)
InChIKeyFEVVSZVWNRRYNZ-UHFFFAOYSA-N
MW345.24 g/mol
LogP3.92
Rot. Bonds5

About 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine

6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 79954125) has the molecular formula C16H17BrN4 and a molecular weight of 345.24 g/mol. Its IUPAC name is 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID79954125
Molecular FormulaC16H17BrN4
Molecular Weight345.24 g/mol
Exact Mass344.06
IUPAC Name6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCC(CCc1ccccc1)Nc1nc(Br)cn2ccnc12
InChIInChI=1S/C16H17BrN4/c1-12(7-8-13-5-3-2-4-6-13)19-15-16-18-9-10-21(16)11-14(17)20-15/h2-6,9-12H,7-8H2,1H3,(H,19,20)
InChIKeyFEVVSZVWNRRYNZ-UHFFFAOYSA-N
XLogP3.92
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.24
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-N-(3-methylpentan-2-yl)imidazo[1,2-a]pyrazin-8-amine
CID 79958977
6-bromo-N-(4-methylpentyl)imidazo[1,2-a]pyrazin-8-amine
CID 79946641
6-bromo-N-[1-(4-chlorophenyl)ethyl]imidazo[1,2-a]pyrazin-8-amine
CID 79958903
6-bromo-N-[(4-propan-2-ylphenyl)methyl]imidazo[1,2-a]pyrazin-8-amine
CID 79954137
6-bromo-N-[1-(5-methylfuran-2-yl)ethyl]imidazo[1,2-a]pyrazin-8-amine
CID 79958014
3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-2-methylsulfanylbutan-1-ol
CID 114152179
6-bromo-N-(4-butylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 79953481
1-methyl-N-(4-phenylbutan-2-yl)imidazol-2-amine
CID 62133485
8-N-(5-methylhexan-2-yl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80838339
6-bromo-N-(2,2-dimethylpropyl)imidazo[1,2-a]pyrazin-8-amine
CID 79958300
6-bromo-N-(2-methoxypropyl)imidazo[1,2-a]pyrazin-8-amine
CID 102699944
3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-2-methylpropan-1-ol
CID 79947296

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine (CID 79954125) is 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine is CC(CCc1ccccc1)Nc1nc(Br)cn2ccnc12.
What is the InChIKey of 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is FEVVSZVWNRRYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrN4/c1-12(7-8-13-5-3-2-4-6-13)19-15-16-18-9-10-21(16)11-14(17)20-15/h2-6,9-12H,7-8H2,1H3,(H,19,20).
What are the key properties of 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine?
6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 345.24 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(4-phenylbutan-2-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 79954125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).