[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol

C14H19BrN4O — CID 106359611

IUPAC[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol
SMILESOCC1CCCCC1NCc1cnc2cnc(Br)cn12
InChIInChI=1S/C14H19BrN4O/c15-13-8-19-11(6-18-14(19)7-17-13)5-16-12-4-2-1-3-10(12)9-20/h6-8,10,12,16,20H,1-5,9H2
InChIKeySIYBWOUTFYVYHE-UHFFFAOYSA-N
MW339.24 g/mol
LogP2.13
Rot. Bonds4

About [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol

[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol (PubChem CID 106359611) has the molecular formula C14H19BrN4O and a molecular weight of 339.24 g/mol. Its IUPAC name is [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol
PubChem CID106359611
Molecular FormulaC14H19BrN4O
Molecular Weight339.24 g/mol
Exact Mass338.07
IUPAC Name[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol
SMILESOCC1CCCCC1NCc1cnc2cnc(Br)cn12
InChIInChI=1S/C14H19BrN4O/c15-13-8-19-11(6-18-14(19)7-17-13)5-16-12-4-2-1-3-10(12)9-20/h6-8,10,12,16,20H,1-5,9H2
InChIKeySIYBWOUTFYVYHE-UHFFFAOYSA-N
XLogP2.13
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.24
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol?
The IUPAC name of [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol (CID 106359611) is [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol?
The canonical SMILES for [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol is OCC1CCCCC1NCc1cnc2cnc(Br)cn12.
What is the InChIKey of [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol?
The InChIKey is SIYBWOUTFYVYHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN4O/c15-13-8-19-11(6-18-14(19)7-17-13)5-16-12-4-2-1-3-10(12)9-20/h6-8,10,12,16,20H,1-5,9H2.
What are the key properties of [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol?
[2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol has a molecular weight of 339.24 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(6-bromoimidazo[1,2-a]pyrazin-3-yl)methylamino]cyclohexyl]methanol is sourced from PubChem (CID 106359611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).