N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine

C24H28N4 — CID 1121243

IUPACN-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine
SMILESCc1ccc(-c2cn3c4ccccc4nc3n2CCNC2CCCCC2)cc1
InChIInChI=1S/C24H28N4/c1-18-11-13-19(14-12-18)23-17-28-22-10-6-5-9-21(22)26-24(28)27(23)16-15-25-20-7-3-2-4-8-20/h5-6,9-14,17,20,25H,2-4,7-8,15-16H2,1H3
InChIKeyWQYSFGWWKKDJGC-UHFFFAOYSA-N
MW372.52 g/mol
LogP5.19
Rot. Bonds5

About N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine

N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine (PubChem CID 1121243) has the molecular formula C24H28N4 and a molecular weight of 372.52 g/mol. Its IUPAC name is N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine.

Molecular Properties

Compound NameN-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine
PubChem CID1121243
Molecular FormulaC24H28N4
Molecular Weight372.52 g/mol
Exact Mass372.23
IUPAC NameN-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine
SMILESCc1ccc(-c2cn3c4ccccc4nc3n2CCNC2CCCCC2)cc1
InChIInChI=1S/C24H28N4/c1-18-11-13-19(14-12-18)23-17-28-22-10-6-5-9-21(22)26-24(28)27(23)16-15-25-20-7-3-2-4-8-20/h5-6,9-14,17,20,25H,2-4,7-8,15-16H2,1H3
InChIKeyWQYSFGWWKKDJGC-UHFFFAOYSA-N
XLogP5.19
TPSA34.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.52
LogP ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[2-(4-chlorophenyl)imidazo[1,2-a]benzimidazol-3-yl]propyl]cyclohexanamine;dihydrochloride
CID 2868552
N-[2-(2-propylbenzimidazol-1-yl)ethyl]cyclopentanamine
CID 115971115
2-[2-(4-ethylphenyl)imidazo[1,2-a]benzimidazol-3-yl]-N-methylethanamine
CID 86303576
2-[2-(4-chlorophenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl-cyclohexylazanium
CID 7335047
2-(4-methoxyphenyl)-3-(2-piperidin-1-ylethyl)imidazo[1,2-a]benzimidazole;hydrochloride
CID 126476325
N-[2-(2-methylbenzimidazol-1-yl)ethyl]oxepan-4-amine
CID 65076508
2-(4-methoxyphenyl)-3-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole
CID 5052019
2-(4-ethylphenyl)-3-(2-piperidin-1-ium-1-ylethyl)imidazo[1,2-a]benzimidazole
CID 4106183
1-methyl-N-[2-(2-methylbenzimidazol-1-yl)ethyl]piperidin-4-amine
CID 28712904
2-(4-chlorophenyl)-3-(3-chloropropyl)imidazo[1,2-a]benzimidazole
CID 3374476
1-[2-(cyclohexylamino)ethyl]quinoxalin-2-one
CID 62562469
N-[2-(2-methylbenzimidazol-1-yl)ethyl]thian-4-amine
CID 43394941

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine?
The IUPAC name of N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine (CID 1121243) is N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine.
What is the SMILES notation for N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine?
The canonical SMILES for N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine is Cc1ccc(-c2cn3c4ccccc4nc3n2CCNC2CCCCC2)cc1.
What is the InChIKey of N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine?
The InChIKey is WQYSFGWWKKDJGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4/c1-18-11-13-19(14-12-18)23-17-28-22-10-6-5-9-21(22)26-24(28)27(23)16-15-25-20-7-3-2-4-8-20/h5-6,9-14,17,20,25H,2-4,7-8,15-16H2,1H3.
What are the key properties of N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine?
N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine has a molecular weight of 372.52 g/mol, XLogP of 5.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(4-methylphenyl)imidazo[1,2-a]benzimidazol-3-yl]ethyl]cyclohexanamine is sourced from PubChem (CID 1121243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).