2-propan-2-yl-5-tritio-1H-benzimidazole

C10H12N2 — CID 155790123

IUPAC2-propan-2-yl-5-tritio-1H-benzimidazole
SMILES[3H]c1ccc2[nH]c(C(C)C)nc2c1
InChIInChI=1S/C10H12N2/c1-7(2)10-11-8-5-3-4-6-9(8)12-10/h3-7H,1-2H3,(H,11,12)/i3T
InChIKeyRITUGMAIQCZEOG-WJULDGBESA-N
MW162.23 g/mol
LogP2.69
Rot. Bonds1

About 2-propan-2-yl-5-tritio-1H-benzimidazole

2-propan-2-yl-5-tritio-1H-benzimidazole (PubChem CID 155790123) has the molecular formula C10H12N2 and a molecular weight of 162.23 g/mol. Its IUPAC name is 2-propan-2-yl-5-tritio-1H-benzimidazole.

Molecular Properties

Compound Name2-propan-2-yl-5-tritio-1H-benzimidazole
PubChem CID155790123
Molecular FormulaC10H12N2
Molecular Weight162.23 g/mol
Exact Mass162.11
IUPAC Name2-propan-2-yl-5-tritio-1H-benzimidazole
SMILES[3H]c1ccc2[nH]c(C(C)C)nc2c1
InChIInChI=1S/C10H12N2/c1-7(2)10-11-8-5-3-4-6-9(8)12-10/h3-7H,1-2H3,(H,11,12)/i3T
InChIKeyRITUGMAIQCZEOG-WJULDGBESA-N
XLogP2.69
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-propan-2-yl-1-tritiobenzimidazole;2-propan-2-yl-4-tritio-1H-benzimidazole;2-propan-2-yl-5-tritio-1H-benzimidazole
CID 159955458
2-propan-2-yl-1H-benzimidazole
CID 22121
2-propan-2-yl-4-tritio-1H-benzimidazole
CID 155790208
6-phenyl-2-propan-2-yl-1H-benzimidazole
CID 58158979
(1S)-1-(1H-benzimidazol-2-yl)ethanol
CID 139074850
1-iodo-2,3,4,5-tetramethylbenzene;2-propan-2-yl-1H-benzimidazole
CID 123134181
[(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropyl]azanium
CID 7008225
CID 162266881
CID 162266881
(1R)-1-(1H-benzimidazol-2-yl)-2-methylpropan-1-amine;dihydrochloride
CID 112756298
2-propan-2-yl-3H-benzimidazole-5-carboxylic acid;hydrochloride
CID 17368247
4-[1-(1H-benzimidazol-2-yl)ethyl]-1,2,4-triazolidine-3,5-dione
CID 107409781
bis(1H-benzimidazol-2-yl)methanol
CID 3747179

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-5-tritio-1H-benzimidazole?
The IUPAC name of 2-propan-2-yl-5-tritio-1H-benzimidazole (CID 155790123) is 2-propan-2-yl-5-tritio-1H-benzimidazole.
What is the SMILES notation for 2-propan-2-yl-5-tritio-1H-benzimidazole?
The canonical SMILES for 2-propan-2-yl-5-tritio-1H-benzimidazole is [3H]c1ccc2[nH]c(C(C)C)nc2c1.
What is the InChIKey of 2-propan-2-yl-5-tritio-1H-benzimidazole?
The InChIKey is RITUGMAIQCZEOG-WJULDGBESA-N. The full InChI is InChI=1S/C10H12N2/c1-7(2)10-11-8-5-3-4-6-9(8)12-10/h3-7H,1-2H3,(H,11,12)/i3T.
What are the key properties of 2-propan-2-yl-5-tritio-1H-benzimidazole?
2-propan-2-yl-5-tritio-1H-benzimidazole has a molecular weight of 162.23 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-5-tritio-1H-benzimidazole is sourced from PubChem (CID 155790123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).