3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol

C13H17BrN4O — CID 106137338

IUPAC3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol
SMILESOC1CCCC(CNc2nc(Br)cn3ccnc23)C1
InChIInChI=1S/C13H17BrN4O/c14-11-8-18-5-4-15-13(18)12(17-11)16-7-9-2-1-3-10(19)6-9/h4-5,8-10,19H,1-3,6-7H2,(H,16,17)
InChIKeyRJISYDHXQGGVSF-UHFFFAOYSA-N
MW325.21 g/mol
LogP2.45
Rot. Bonds3

About 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol

3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 106137338) has the molecular formula C13H17BrN4O and a molecular weight of 325.21 g/mol. Its IUPAC name is 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol
PubChem CID106137338
Molecular FormulaC13H17BrN4O
Molecular Weight325.21 g/mol
Exact Mass324.06
IUPAC Name3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol
SMILESOC1CCCC(CNc2nc(Br)cn3ccnc23)C1
InChIInChI=1S/C13H17BrN4O/c14-11-8-18-5-4-15-13(18)12(17-11)16-7-9-2-1-3-10(19)6-9/h4-5,8-10,19H,1-3,6-7H2,(H,16,17)
InChIKeyRJISYDHXQGGVSF-UHFFFAOYSA-N
XLogP2.45
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.21
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol with MolForge

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Related Compounds

6-bromo-N-[(2-methylcyclopentyl)methyl]imidazo[1,2-a]pyrazin-8-amine
CID 107420085
8-N-(cyclobutylmethyl)-6-N-methylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80784676
6-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyrazin-8-amine
CID 79955875
5-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]pyrrolidin-2-one
CID 79946656
[2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]cyclopentyl]methanol
CID 114179118
1-cyclopropyl-3-[(3-hydroxycyclohexyl)methylamino]pyrazin-2-one
CID 103931018
3-[(pyrazolo[1,5-a]pyrazin-4-ylamino)methyl]cyclohexan-1-ol
CID 106129764
1-ethyl-3-[(3-hydroxycyclohexyl)methylamino]pyrazin-2-one
CID 113349523
3-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]propanamide
CID 79958127
3-[2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]ethylsulfanyl]propan-1-ol
CID 106311300
3-[(3-hydroxycyclohexyl)methylamino]-1-propylpyrazin-2-one
CID 106129389
2-[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]-N,N-dimethylacetamide
CID 79956326

Frequently Asked Questions

What is the IUPAC name of 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol (CID 106137338) is 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol is OC1CCCC(CNc2nc(Br)cn3ccnc23)C1.
What is the InChIKey of 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is RJISYDHXQGGVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17BrN4O/c14-11-8-18-5-4-15-13(18)12(17-11)16-7-9-2-1-3-10(19)6-9/h4-5,8-10,19H,1-3,6-7H2,(H,16,17).
What are the key properties of 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol?
3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 325.21 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(6-bromoimidazo[1,2-a]pyrazin-8-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 106137338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).