1H-benzimidazole;bis(pyrimidine)

C15H14N6 — CID 162103575

IUPAC1H-benzimidazole;bis(pyrimidine)
SMILESc1ccc2[nH]cnc2c1.c1cncnc1.c1cncnc1
InChIInChI=1S/C7H6N2.2C4H4N2/c1-2-4-7-6(3-1)8-5-9-7;2*1-2-5-4-6-3-1/h1-5H,(H,8,9);2*1-4H
InChIKeyZFFCHZUIRJZOLL-UHFFFAOYSA-N
MW278.32 g/mol
LogP2.52
Rot. Bonds

About 1H-benzimidazole;bis(pyrimidine)

1H-benzimidazole;bis(pyrimidine) (PubChem CID 162103575) has the molecular formula C15H14N6 and a molecular weight of 278.32 g/mol. Its IUPAC name is 1H-benzimidazole;bis(pyrimidine).

Molecular Properties

Compound Name1H-benzimidazole;bis(pyrimidine)
PubChem CID162103575
Molecular FormulaC15H14N6
Molecular Weight278.32 g/mol
Exact Mass278.13
IUPAC Name1H-benzimidazole;bis(pyrimidine)
SMILESc1ccc2[nH]cnc2c1.c1cncnc1.c1cncnc1
InChIInChI=1S/C7H6N2.2C4H4N2/c1-2-4-7-6(3-1)8-5-9-7;2*1-2-5-4-6-3-1/h1-5H,(H,8,9);2*1-4H
InChIKeyZFFCHZUIRJZOLL-UHFFFAOYSA-N
XLogP2.52
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

disilver;1H-benzimidazole
CID 21437015
bis(1H-benzimidazole);hydrate
CID 23293238
bis(1H-benzimidazole);hydrochloride
CID 163717509
1H-benzimidazole;manganese
CID 158140840
1H-benzimidazole;zinc
CID 162235320
acetylene;bis(1H-benzimidazole)
CID 143659644
calcium;1H-benzimidazole;hydride
CID 174891856
1H-benzimidazole;cyclopropene
CID 175111337
bis(1H-benzimidazole);dichlorocopper
CID 11984972
1H-benzimidazole;ethane;molecular hydrogen
CID 142113314
1H-benzimidazole;propane;hydroiodide
CID 172791937
1H-benzimidazole;piperidine;pyridine
CID 157406535

Frequently Asked Questions

What is the IUPAC name of 1H-benzimidazole;bis(pyrimidine)?
The IUPAC name of 1H-benzimidazole;bis(pyrimidine) (CID 162103575) is 1H-benzimidazole;bis(pyrimidine).
What is the SMILES notation for 1H-benzimidazole;bis(pyrimidine)?
The canonical SMILES for 1H-benzimidazole;bis(pyrimidine) is c1ccc2[nH]cnc2c1.c1cncnc1.c1cncnc1.
What is the InChIKey of 1H-benzimidazole;bis(pyrimidine)?
The InChIKey is ZFFCHZUIRJZOLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2.2C4H4N2/c1-2-4-7-6(3-1)8-5-9-7;2*1-2-5-4-6-3-1/h1-5H,(H,8,9);2*1-4H.
What are the key properties of 1H-benzimidazole;bis(pyrimidine)?
1H-benzimidazole;bis(pyrimidine) has a molecular weight of 278.32 g/mol, XLogP of 2.52, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-benzimidazole;bis(pyrimidine) is sourced from PubChem (CID 162103575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).