N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide

C22H22N8O2 — CID 175883788

IUPACN-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide
SMILESNc1ncc(-c2cn3cc(CNC(=O)c4ccccc4)nc3c(N3CCOCC3)n2)cn1
InChIInChI=1S/C22H22N8O2/c23-22-25-10-16(11-26-22)18-14-30-13-17(12-24-21(31)15-4-2-1-3-5-15)27-19(30)20(28-18)29-6-8-32-9-7-29/h1-5,10-11,13-14H,6-9,12H2,(H,24,31)(H2,23,25,26)
InChIKeyNGQLSWYKSVWKSS-UHFFFAOYSA-N
MW430.47 g/mol
LogP1.54
Rot. Bonds5

About N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide

N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide (PubChem CID 175883788) has the molecular formula C22H22N8O2 and a molecular weight of 430.47 g/mol. Its IUPAC name is N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide.

Molecular Properties

Compound NameN-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide
PubChem CID175883788
Molecular FormulaC22H22N8O2
Molecular Weight430.47 g/mol
Exact Mass430.19
IUPAC NameN-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide
SMILESNc1ncc(-c2cn3cc(CNC(=O)c4ccccc4)nc3c(N3CCOCC3)n2)cn1
InChIInChI=1S/C22H22N8O2/c23-22-25-10-16(11-26-22)18-14-30-13-17(12-24-21(31)15-4-2-1-3-5-15)27-19(30)20(28-18)29-6-8-32-9-7-29/h1-5,10-11,13-14H,6-9,12H2,(H,24,31)(H2,23,25,26)
InChIKeyNGQLSWYKSVWKSS-UHFFFAOYSA-N
XLogP1.54
TPSA123.56 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.47
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Related Compounds

2-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl-methylamino]-N-hydroxypyrimidine-5-carboxamide
CID 71466706
6-(2-aminopyrimidin-5-yl)-N-(3-methoxypropyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 70694722
5-(2-methyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-6-yl)pyrimidin-2-amine
CID 90067946
5-(2-cyclopropyl-8-morpholin-4-ylimidazo[1,2-a]pyrazin-6-yl)pyrimidin-2-amine
CID 90067938
ethyl 4-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carbonyl]amino]piperidine-1-carboxylate
CID 90067991
N-[[3-[(2S)-1-acetyl-2-methyl-3,4-dihydro-2H-quinolin-6-yl]phenyl]methyl]-6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 162374488
N-[[5-(1-acetyl-2-methyl-3,4-dihydro-2H-quinolin-6-yl)thiophen-2-yl]methyl]-6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 162374373
5-[8-morpholin-4-yl-2-(phenylmethoxymethyl)-[1,2,4]triazolo[1,5-a]pyrazin-6-yl]pyrimidin-2-amine
CID 118213413
N-[(6-bromo-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl)methyl]acetamide
CID 175883938
4-[[6-(3-hydroxyphenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]piperazine-1-carboxylic acid
CID 90067954
3-[8-morpholin-4-yl-2-(morpholin-4-ylmethyl)imidazo[1,2-a]pyrazin-6-yl]phenol
CID 57394839
cesium;N-[[4-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)phenyl]methyl]-6-(2-aminopyrimidin-5-yl)-8-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxamide;carbanide;ethane
CID 162374338

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide?
The IUPAC name of N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide (CID 175883788) is N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide.
What is the SMILES notation for N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide?
The canonical SMILES for N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide is Nc1ncc(-c2cn3cc(CNC(=O)c4ccccc4)nc3c(N3CCOCC3)n2)cn1.
What is the InChIKey of N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide?
The InChIKey is NGQLSWYKSVWKSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N8O2/c23-22-25-10-16(11-26-22)18-14-30-13-17(12-24-21(31)15-4-2-1-3-5-15)27-19(30)20(28-18)29-6-8-32-9-7-29/h1-5,10-11,13-14H,6-9,12H2,(H,24,31)(H2,23,25,26).
What are the key properties of N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide?
N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide has a molecular weight of 430.47 g/mol, XLogP of 1.54, 5 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-aminopyrimidin-5-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]benzamide is sourced from PubChem (CID 175883788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).