N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine

C27H29N7O2 — CID 91368408

IUPACN-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCCOc1cc(Nc2nc(-c3cc(CC)c4cn[nH]c4c3)cn3ccnc23)ccc1N1CCOCC1
InChIInChI=1S/C27H29N7O2/c1-3-18-13-19(14-22-21(18)16-29-32-22)23-17-34-8-7-28-27(34)26(31-23)30-20-5-6-24(25(15-20)36-4-2)33-9-11-35-12-10-33/h5-8,13-17H,3-4,9-12H2,1-2H3,(H,29,32)(H,30,31)
InChIKeyZOLREJOBKCJUQK-UHFFFAOYSA-N
MW483.58 g/mol
LogP4.81
Rot. Bonds7

About N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine

N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 91368408) has the molecular formula C27H29N7O2 and a molecular weight of 483.58 g/mol. Its IUPAC name is N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID91368408
Molecular FormulaC27H29N7O2
Molecular Weight483.58 g/mol
Exact Mass483.24
IUPAC NameN-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine
SMILESCCOc1cc(Nc2nc(-c3cc(CC)c4cn[nH]c4c3)cn3ccnc23)ccc1N1CCOCC1
InChIInChI=1S/C27H29N7O2/c1-3-18-13-19(14-22-21(18)16-29-32-22)23-17-34-8-7-28-27(34)26(31-23)30-20-5-6-24(25(15-20)36-4-2)33-9-11-35-12-10-33/h5-8,13-17H,3-4,9-12H2,1-2H3,(H,29,32)(H,30,31)
InChIKeyZOLREJOBKCJUQK-UHFFFAOYSA-N
XLogP4.81
TPSA92.60 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.58
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

(3R)-1-[2-ethoxy-4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]pyrrolidin-3-ol
CID 59473647
2-[2-morpholin-4-yl-5-[[6-(1H-pyrrolo[3,2-b]pyridin-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenoxy]ethanol
CID 59473076
[(2S)-4-[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]morpholin-2-yl]methanol
CID 59473303
N-(3-methoxy-4-morpholin-4-ylphenyl)-6-[5-(methylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-amine
CID 59473561
1-[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]piperidin-4-ol
CID 59473477
6-(1H-indazol-6-yl)-N-[3-methoxy-4-[4-(2-methoxyethyl)piperazin-1-yl]phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 59473323
6-(2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-7-yl)-N-[3-methoxy-4-(1,4-oxazepan-4-yl)phenyl]imidazo[1,2-a]pyrazin-8-amine
CID 90028354
7-[8-(3-methoxy-4-morpholin-4-ylanilino)imidazo[1,2-a]pyrazin-6-yl]-3,4-dihydro-2H-1,4-benzoxazepin-5-one
CID 72695166
6-(3,4-dihydro-2H-pyrano[2,3-b]pyridin-6-yl)-N-(3-methoxy-4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 148686575
(3S)-1-[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]pyrrolidin-3-ol
CID 59473271
(3R)-1-[4-[[6-(1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methoxyphenyl]pyrrolidin-3-ol
CID 59473382
6-(5-ethyl-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 147813694

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine (CID 91368408) is N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine is CCOc1cc(Nc2nc(-c3cc(CC)c4cn[nH]c4c3)cn3ccnc23)ccc1N1CCOCC1.
What is the InChIKey of N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is ZOLREJOBKCJUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H29N7O2/c1-3-18-13-19(14-22-21(18)16-29-32-22)23-17-34-8-7-28-27(34)26(31-23)30-20-5-6-24(25(15-20)36-4-2)33-9-11-35-12-10-33/h5-8,13-17H,3-4,9-12H2,1-2H3,(H,29,32)(H,30,31).
What are the key properties of N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine?
N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 483.58 g/mol, XLogP of 4.81, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-4-morpholin-4-ylphenyl)-6-(4-ethyl-1H-indazol-6-yl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 91368408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).