6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol

C24H20N4O2 — CID 137285428

IUPAC6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol
SMILESNc1cccc(-c2cn3c(O)c(Cc4ccco4)nc3c(Cc3ccccc3)n2)c1
InChIInChI=1S/C24H20N4O2/c25-18-9-4-8-17(13-18)22-15-28-23(20(26-22)12-16-6-2-1-3-7-16)27-21(24(28)29)14-19-10-5-11-30-19/h1-11,13,15,29H,12,14,25H2
InChIKeyROFAKKUMBJWAHH-UHFFFAOYSA-N
MW396.45 g/mol
LogP4.46
Rot. Bonds5

About 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol

6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol (PubChem CID 137285428) has the molecular formula C24H20N4O2 and a molecular weight of 396.45 g/mol. Its IUPAC name is 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

Compound Name6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol
PubChem CID137285428
Molecular FormulaC24H20N4O2
Molecular Weight396.45 g/mol
Exact Mass396.16
IUPAC Name6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol
SMILESNc1cccc(-c2cn3c(O)c(Cc4ccco4)nc3c(Cc3ccccc3)n2)c1
InChIInChI=1S/C24H20N4O2/c25-18-9-4-8-17(13-18)22-15-28-23(20(26-22)12-16-6-2-1-3-7-16)27-21(24(28)29)14-19-10-5-11-30-19/h1-11,13,15,29H,12,14,25H2
InChIKeyROFAKKUMBJWAHH-UHFFFAOYSA-N
XLogP4.46
TPSA89.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.45
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(furan-2-yl)-8-methyl-N-(2-methylphenyl)imidazo(1,2-a)pyridin-3-amine
CID 4179181
N-(2,6-dimethylbenzyl)-6-(furan-2-yl)-2,3-dimethylimidazo[1,2-a]pyridin-8-amine
CID 24890348
4-[8-(4-Morpholin-4-ylanilino)imidazo[1,2-a]pyrazin-5-yl]furan-2-carboxamide
CID 57395763
N2-(4-amino-cyclohexyl)-9-cyclopentyl-N6-(6-furan-3-yl-pyridin-3-ylmethyl)-9H-purine-2,6-diamine
CID 73350613
4-{3-[(Furan-2-ylmethyl)-amino]-imidazo[1,2-a]pyridin-2-yl}-phenol
CID 858019
2-(furan-2-yl)-6-methyl-N-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 4337112
N-[2-(4-Ethoxyphenyl)ethyl]-3-{2-methyl-3H-imidazo[4,5-B]pyridin-3-YL}benzamide
CID 16022307
N-[6-(furan-3-yl)-3-phenylimidazo[1,2-a]pyridin-8-yl]acetamide
CID 49791134
3-Benzyl-2-(furan-2-yl)-6-methylimidazo[1,2-a]pyridine
CID 51359014
2-[4-[7-(Furan-2-yl)imidazo[1,2-a]pyridin-3-yl]phenyl]acetonitrile
CID 118733893
7-(Furan-2-yl)-3-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 118733894
3-(4-Fluorophenyl)-7-(furan-2-yl)imidazo[1,2-a]pyridine
CID 118733895

Frequently Asked Questions

What is the IUPAC name of 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
The IUPAC name of 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol (CID 137285428) is 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol.
What is the SMILES notation for 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
The canonical SMILES for 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol is Nc1cccc(-c2cn3c(O)c(Cc4ccco4)nc3c(Cc3ccccc3)n2)c1.
What is the InChIKey of 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
The InChIKey is ROFAKKUMBJWAHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O2/c25-18-9-4-8-17(13-18)22-15-28-23(20(26-22)12-16-6-2-1-3-7-16)27-21(24(28)29)14-19-10-5-11-30-19/h1-11,13,15,29H,12,14,25H2.
What are the key properties of 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol?
6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol has a molecular weight of 396.45 g/mol, XLogP of 4.46, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminophenyl)-8-benzyl-2-(furan-2-ylmethyl)imidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 137285428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).