6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline

C25H27N5 — CID 143498497

IUPAC6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline
SMILESCCn1c(C2CCCCC2)nc(-c2cccc(C)n2)c1-c1ccc2nccnc2c1
InChIInChI=1S/C25H27N5/c1-3-30-24(19-12-13-20-22(16-19)27-15-14-26-20)23(21-11-7-8-17(2)28-21)29-25(30)18-9-5-4-6-10-18/h7-8,11-16,18H,3-6,9-10H2,1-2H3
InChIKeyCCQSEBLSISQEAE-UHFFFAOYSA-N
MW397.53 g/mol
LogP5.93
Rot. Bonds4

About 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline

6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline (PubChem CID 143498497) has the molecular formula C25H27N5 and a molecular weight of 397.53 g/mol. Its IUPAC name is 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline.

Molecular Properties

Compound Name6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline
PubChem CID143498497
Molecular FormulaC25H27N5
Molecular Weight397.53 g/mol
Exact Mass397.23
IUPAC Name6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline
SMILESCCn1c(C2CCCCC2)nc(-c2cccc(C)n2)c1-c1ccc2nccnc2c1
InChIInChI=1S/C25H27N5/c1-3-30-24(19-12-13-20-22(16-19)27-15-14-26-20)23(21-11-7-8-17(2)28-21)29-25(30)18-9-5-4-6-10-18/h7-8,11-16,18H,3-6,9-10H2,1-2H3
InChIKeyCCQSEBLSISQEAE-UHFFFAOYSA-N
XLogP5.93
TPSA56.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.53
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-bromo-4-(6-methyl-2-pyridinyl)-2,5-diazatricyclo[5.2.1.02,6]deca-3,5-diene;bis(4-(6-methyl-2-pyridinyl)-3-quinoxalin-6-yl-2,5-diazatricyclo[5.2.1.02,6]deca-3,5-diene);6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinoxaline
CID 157306403
2-[7-[4-(6-methyl-2-pyridinyl)-2,5-diazatricyclo[5.2.1.02,6]deca-3,5-dien-3-yl]quinoxalin-2-yl]oxyethanol
CID 134439804
3-(6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1,2-oxazole
CID 22180762
2-[5-(1,3-benzodioxol-5-yl)-2-(1,4-dioxaspiro[4.5]decan-8-yl)-1-prop-2-enylimidazol-4-yl]-6-methylpyridine
CID 143498601
(1R)-4-(6-methyl-2-pyridinyl)-3-[2-(4-methylsulfinylphenyl)-4-pyridinyl]-2,5-diazatricyclo[5.2.1.02,6]deca-3,5-diene
CID 134439691
N-[4-[5-(6-methyl-2-pyridinyl)-4-quinoxalin-6-yl-1H-imidazol-2-yl]cyclohexyl]acetamide
CID 10387752
(2S)-3-[[4-[(1R,7S)-4-(6-methyl-2-pyridinyl)-2,5-diazatricyclo[5.2.1.02,6]deca-3,5-dien-3-yl]-2-pyridinyl]amino]propane-1,2-diol
CID 134439613
5-(4-chlorophenyl)-2-cyclohexyl-3-ethylimidazol-4-amine
CID 63468570
1-[4-[4-[4-(6-methyl-2-pyridinyl)-2,5-diazatricyclo[5.2.1.02,6]deca-3,5-dien-3-yl]-2-pyridinyl]phenyl]-2-(oxan-4-yl)ethanone
CID 157103661
(2S)-1-[[4-[(1R)-4-(6-methyl-2-pyridinyl)-3,6-diazatricyclo[6.2.1.02,6]undeca-2,4-dien-5-yl]-2-pyridinyl]amino]propan-2-ol
CID 146389765
2-cyclopentyl-5-(2,3-difluorophenyl)-3-ethylimidazol-4-amine
CID 63667204
N,N-dimethyl-2-(6-methyl-2-pyridinyl)-3-quinolin-6-ylimidazo[1,2-a]pyrimidin-7-amine
CID 10317641

Frequently Asked Questions

What is the IUPAC name of 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline?
The IUPAC name of 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline (CID 143498497) is 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline.
What is the SMILES notation for 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline?
The canonical SMILES for 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline is CCn1c(C2CCCCC2)nc(-c2cccc(C)n2)c1-c1ccc2nccnc2c1.
What is the InChIKey of 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline?
The InChIKey is CCQSEBLSISQEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N5/c1-3-30-24(19-12-13-20-22(16-19)27-15-14-26-20)23(21-11-7-8-17(2)28-21)29-25(30)18-9-5-4-6-10-18/h7-8,11-16,18H,3-6,9-10H2,1-2H3.
What are the key properties of 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline?
6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline has a molecular weight of 397.53 g/mol, XLogP of 5.93, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-cyclohexyl-3-ethyl-5-(6-methyl-2-pyridinyl)imidazol-4-yl]quinoxaline is sourced from PubChem (CID 143498497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).