4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol

C18H19BrN4O — CID 155179314

IUPAC4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESOc1ccc(Br)c(-c2nc3cnccn3c2NC2CCCCC2)c1
InChIInChI=1S/C18H19BrN4O/c19-15-7-6-13(24)10-14(15)17-18(21-12-4-2-1-3-5-12)23-9-8-20-11-16(23)22-17/h6-12,21,24H,1-5H2
InChIKeyOXSGGSCRBSQBPZ-UHFFFAOYSA-N
MW387.28 g/mol
LogP4.61
Rot. Bonds3

About 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol

4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol (PubChem CID 155179314) has the molecular formula C18H19BrN4O and a molecular weight of 387.28 g/mol. Its IUPAC name is 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol.

Molecular Properties

Compound Name4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol
PubChem CID155179314
Molecular FormulaC18H19BrN4O
Molecular Weight387.28 g/mol
Exact Mass386.07
IUPAC Name4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESOc1ccc(Br)c(-c2nc3cnccn3c2NC2CCCCC2)c1
InChIInChI=1S/C18H19BrN4O/c19-15-7-6-13(24)10-14(15)17-18(21-12-4-2-1-3-5-12)23-9-8-20-11-16(23)22-17/h6-12,21,24H,1-5H2
InChIKeyOXSGGSCRBSQBPZ-UHFFFAOYSA-N
XLogP4.61
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.28
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3-(cyclopentylamino)imidazo[1,2-a]pyrazin-2-yl]benzene-1,2-diol
CID 135674297
N-cyclohexyl-2-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-3-amine
CID 174194223
N-cyclohexyl-2-(1H-inden-2-yl)imidazo[1,2-a]pyrazin-3-amine
CID 162166087
1-[3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]indol-1-yl]ethanone
CID 138535975
N,2-dicyclohexylimidazo[1,2-a]pyrazin-3-amine
CID 138535553
N-cyclohexyl-2-(7-methyl-1H-indol-3-yl)imidazo[1,2-a]pyrazin-3-amine
CID 138535791
4-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 138535788
N-cyclohexyl-2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)-2-methoxyphenyl]imidazo[1,2-a]pyrazin-3-amine
CID 132585236
2-[3-(3-chlorophenyl)-4-methoxyphenyl]-N-cyclohexylimidazo[1,2-a]pyrazin-3-amine
CID 42601027
4-[3-(cyclopentylamino)imidazo[1,2-a]pyridin-2-yl]phenol
CID 861692
5-chloro-2-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]phenol
CID 143959387
6-bromo-N-cyclohexyl-2-pyridin-4-ylimidazo[1,2-a]pyridin-3-amine
CID 1154359

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
The IUPAC name of 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol (CID 155179314) is 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol.
What is the SMILES notation for 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
The canonical SMILES for 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol is Oc1ccc(Br)c(-c2nc3cnccn3c2NC2CCCCC2)c1.
What is the InChIKey of 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
The InChIKey is OXSGGSCRBSQBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19BrN4O/c19-15-7-6-13(24)10-14(15)17-18(21-12-4-2-1-3-5-12)23-9-8-20-11-16(23)22-17/h6-12,21,24H,1-5H2.
What are the key properties of 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol?
4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol has a molecular weight of 387.28 g/mol, XLogP of 4.61, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-3-[3-(cyclohexylamino)imidazo[1,2-a]pyrazin-2-yl]phenol is sourced from PubChem (CID 155179314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).