4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol

C12H15BrN4O — CID 79955512

IUPAC4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol
SMILESOC1CCC(Nc2nc(Br)cn3ccnc23)CC1
InChIInChI=1S/C12H15BrN4O/c13-10-7-17-6-5-14-12(17)11(16-10)15-8-1-3-9(18)4-2-8/h5-9,18H,1-4H2,(H,15,16)
InChIKeySFWOPSFPTVMNOO-UHFFFAOYSA-N
MW311.18 g/mol
LogP2.21
Rot. Bonds2

About 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol

4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol (PubChem CID 79955512) has the molecular formula C12H15BrN4O and a molecular weight of 311.18 g/mol. Its IUPAC name is 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol
PubChem CID79955512
Molecular FormulaC12H15BrN4O
Molecular Weight311.18 g/mol
Exact Mass310.04
IUPAC Name4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol
SMILESOC1CCC(Nc2nc(Br)cn3ccnc23)CC1
InChIInChI=1S/C12H15BrN4O/c13-10-7-17-6-5-14-12(17)11(16-10)15-8-1-3-9(18)4-2-8/h5-9,18H,1-4H2,(H,15,16)
InChIKeySFWOPSFPTVMNOO-UHFFFAOYSA-N
XLogP2.21
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.18
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol (CID 79955512) is 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol is OC1CCC(Nc2nc(Br)cn3ccnc23)CC1.
What is the InChIKey of 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol?
The InChIKey is SFWOPSFPTVMNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15BrN4O/c13-10-7-17-6-5-14-12(17)11(16-10)15-8-1-3-9(18)4-2-8/h5-9,18H,1-4H2,(H,15,16).
What are the key properties of 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol?
4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol has a molecular weight of 311.18 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 79955512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).