[4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol

C22H18N4O — CID 155555121

IUPAC[4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol
SMILESCn1ccc2cc(-c3cn4c(-c5ccc(CO)cc5)cnc4cn3)ccc21
InChIInChI=1S/C22H18N4O/c1-25-9-8-18-10-17(6-7-20(18)25)19-13-26-21(11-24-22(26)12-23-19)16-4-2-15(14-27)3-5-16/h2-13,27H,14H2,1H3
InChIKeyLKGGELUCFBYIDO-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.05
Rot. Bonds3

About [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol

[4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol (PubChem CID 155555121) has the molecular formula C22H18N4O and a molecular weight of 354.41 g/mol. Its IUPAC name is [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol.

Molecular Properties

Compound Name[4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol
PubChem CID155555121
Molecular FormulaC22H18N4O
Molecular Weight354.41 g/mol
Exact Mass354.15
IUPAC Name[4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol
SMILESCn1ccc2cc(-c3cn4c(-c5ccc(CO)cc5)cnc4cn3)ccc21
InChIInChI=1S/C22H18N4O/c1-25-9-8-18-10-17(6-7-20(18)25)19-13-26-21(11-24-22(26)12-23-19)16-4-2-15(14-27)3-5-16/h2-13,27H,14H2,1H3
InChIKeyLKGGELUCFBYIDO-UHFFFAOYSA-N
XLogP4.05
TPSA55.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[8-Amino-1-[4-(1-hydroxy-1-phenylethyl)phenyl]imidazo[1,5-a]pyrazin-3-yl]-1-methylcyclobutan-1-ol
CID 44468332
(4-{4-Chloro-1-Methyl-2-[4-(Piperazin-1-Yl)phenyl]-1h-Pyrrolo[2,3-B]pyridin-3-Yl}phenyl)methanol
CID 53250611
{3-[2-(4-Chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl}methanol
CID 24856034
7-[2-(1-Imidazolyl)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenyl-1-heptanone
CID 455594
3-[N-(2-carboxybenzyl)-5-indolyl]methyl-5,7-dimethyl-2-ethyl-3H-imidazo[4,5-b]pyridine
CID 10048776
4''-(6-Imidazo[1,2-a]pyridin-2-yl-4-methyl-2-propyl-benzoimidazol-1-ylmethyl)-biphenyl-2-carboxylic acid
CID 10074709
[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]cyclohexyl]methanol
CID 24862840
6-(3-(1H-indol-5-yl)benzylamino)-9-(3-hydroxypropyl)-9H-purine-2-carbonitrile
CID 44481507
1-[4-(8-Amino-3-cyclobutylimidazo[1,5-a]pyrazin-1-yl)phenyl]-1-phenylethanol
CID 44539387
12-[3-(Hydroxymethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile
CID 58266473
12-[4-(Hydroxymethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile
CID 58266769
Racemic 1-{3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]phenyl}ethanol
CID 67046247

Frequently Asked Questions

What is the IUPAC name of [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?
The IUPAC name of [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol (CID 155555121) is [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol.
What is the SMILES notation for [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?
The canonical SMILES for [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol is Cn1ccc2cc(-c3cn4c(-c5ccc(CO)cc5)cnc4cn3)ccc21.
What is the InChIKey of [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?
The InChIKey is LKGGELUCFBYIDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O/c1-25-9-8-18-10-17(6-7-20(18)25)19-13-26-21(11-24-22(26)12-23-19)16-4-2-15(14-27)3-5-16/h2-13,27H,14H2,1H3.
What are the key properties of [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol?
[4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol has a molecular weight of 354.41 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(1-methylindol-5-yl)imidazo[1,2-a]pyrazin-3-yl]phenyl]methanol is sourced from PubChem (CID 155555121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).