2-(1H-benzimidazol-2-yl)quinoline

C16H11N3 — CID 646533

IUPAC2-(1H-benzimidazol-2-yl)quinoline
SMILESc1ccc2nc(-c3nc4ccccc4[nH]3)ccc2c1
InChIInChI=1S/C16H11N3/c1-2-6-12-11(5-1)9-10-15(17-12)16-18-13-7-3-4-8-14(13)19-16/h1-10H,(H,18,19)
InChIKeyXSJAMRUTJCSRNB-UHFFFAOYSA-N
MW245.29 g/mol
LogP3.78
Rot. Bonds1

About 2-(1H-benzimidazol-2-yl)quinoline

2-(1H-benzimidazol-2-yl)quinoline (PubChem CID 646533) has the molecular formula C16H11N3 and a molecular weight of 245.29 g/mol. Its IUPAC name is 2-(1H-benzimidazol-2-yl)quinoline.

Molecular Properties

Compound Name2-(1H-benzimidazol-2-yl)quinoline
PubChem CID646533
Molecular FormulaC16H11N3
Molecular Weight245.29 g/mol
Exact Mass245.10
IUPAC Name2-(1H-benzimidazol-2-yl)quinoline
SMILESc1ccc2nc(-c3nc4ccccc4[nH]3)ccc2c1
InChIInChI=1S/C16H11N3/c1-2-6-12-11(5-1)9-10-15(17-12)16-18-13-7-3-4-8-14(13)19-16/h1-10H,(H,18,19)
InChIKeyXSJAMRUTJCSRNB-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-benzimidazol-2-yl)benzo[b][1,10]phenanthroline
CID 175723267
zinc;2-[6-(1H-benzimidazol-2-yl)-2-pyridinyl]-1H-benzimidazole;dichloride
CID 16721057
2-quinolin-2-yl-3H-benzimidazole-5-carbonitrile
CID 79004134
platinum;2-pyridin-2-yl-1H-benzimidazole
CID 174864241
2-(1-methylimidazol-4-yl)-1H-benzimidazole
CID 45078360
2-[4-[4-(1H-benzimidazol-2-yl)phenyl]phenyl]-1H-benzimidazole
CID 12522580
2-(5-quinolin-2-yl-1H-pyrrol-2-yl)quinoline
CID 18470716
2-(1H-benzimidazol-2-yl)imidazo[1,2-a]quinoline
CID 171904842
2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
CID 135804529
copper;palladium;2-pyridin-2-yl-1H-benzimidazole
CID 174748574
2-[6-[5-(1H-benzimidazol-2-yl)-2-pyridinyl]-3-pyridinyl]-1H-benzimidazole
CID 12045900
benzene-1,2-diamine;6-(1H-benzimidazol-2-yl)pyridin-2-amine
CID 159111206

Frequently Asked Questions

What is the IUPAC name of 2-(1H-benzimidazol-2-yl)quinoline?
The IUPAC name of 2-(1H-benzimidazol-2-yl)quinoline (CID 646533) is 2-(1H-benzimidazol-2-yl)quinoline.
What is the SMILES notation for 2-(1H-benzimidazol-2-yl)quinoline?
The canonical SMILES for 2-(1H-benzimidazol-2-yl)quinoline is c1ccc2nc(-c3nc4ccccc4[nH]3)ccc2c1.
What is the InChIKey of 2-(1H-benzimidazol-2-yl)quinoline?
The InChIKey is XSJAMRUTJCSRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3/c1-2-6-12-11(5-1)9-10-15(17-12)16-18-13-7-3-4-8-14(13)19-16/h1-10H,(H,18,19).
What are the key properties of 2-(1H-benzimidazol-2-yl)quinoline?
2-(1H-benzimidazol-2-yl)quinoline has a molecular weight of 245.29 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-benzimidazol-2-yl)quinoline is sourced from PubChem (CID 646533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).