2-fluoro-1-propan-2-ylbenzimidazole

C10H11FN2 — CID 141105255

IUPAC2-fluoro-1-propan-2-ylbenzimidazole
SMILESCC(C)n1c(F)nc2ccccc21
InChIInChI=1S/C10H11FN2/c1-7(2)13-9-6-4-3-5-8(9)12-10(13)11/h3-7H,1-2H3
InChIKeyISOCYTZPJPZKAA-UHFFFAOYSA-N
MW178.21 g/mol
LogP2.76
Rot. Bonds1

About 2-fluoro-1-propan-2-ylbenzimidazole

2-fluoro-1-propan-2-ylbenzimidazole (PubChem CID 141105255) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is 2-fluoro-1-propan-2-ylbenzimidazole.

Molecular Properties

Compound Name2-fluoro-1-propan-2-ylbenzimidazole
PubChem CID141105255
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC Name2-fluoro-1-propan-2-ylbenzimidazole
SMILESCC(C)n1c(F)nc2ccccc21
InChIInChI=1S/C10H11FN2/c1-7(2)13-9-6-4-3-5-8(9)12-10(13)11/h3-7H,1-2H3
InChIKeyISOCYTZPJPZKAA-UHFFFAOYSA-N
XLogP2.76
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-propan-2-yl-2-(trifluoromethyl)benzimidazole
CID 888592
(1R)-1-(1-propan-2-ylbenzimidazol-2-yl)ethanamine
CID 25315233
2-[(1R)-1-chloroethyl]-1-propan-2-ylbenzimidazole
CID 93257413
2-[(E)-2-(4-fluorophenyl)ethenyl]-1-propan-2-ylbenzimidazole
CID 5293130
(1R)-1-(1-propan-2-ylbenzimidazol-2-yl)ethanamine;hydrochloride
CID 133143586
3-fluoro-4-(1-propan-2-ylbenzimidazol-2-yl)phenol
CID 136751548
2-methyl-1-(1-propan-2-ylbenzimidazol-2-yl)propan-1-amine;hydrochloride
CID 122169362
2-(2-phenylethenyl)-1-propan-2-ylbenzimidazole
CID 3787775
1-propan-2-ylbenzimidazole-2-sulfonate
CID 7853257
1-propan-2-yl-2-pyrrolidin-1-ylbenzimidazole
CID 10105231
1-(1-propan-2-ylbenzimidazol-2-yl)propan-2-amine
CID 43171099
2-(1-propan-2-ylbenzimidazol-2-yl)acetonitrile
CID 55247145

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-propan-2-ylbenzimidazole?
The IUPAC name of 2-fluoro-1-propan-2-ylbenzimidazole (CID 141105255) is 2-fluoro-1-propan-2-ylbenzimidazole.
What is the SMILES notation for 2-fluoro-1-propan-2-ylbenzimidazole?
The canonical SMILES for 2-fluoro-1-propan-2-ylbenzimidazole is CC(C)n1c(F)nc2ccccc21.
What is the InChIKey of 2-fluoro-1-propan-2-ylbenzimidazole?
The InChIKey is ISOCYTZPJPZKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2/c1-7(2)13-9-6-4-3-5-8(9)12-10(13)11/h3-7H,1-2H3.
What are the key properties of 2-fluoro-1-propan-2-ylbenzimidazole?
2-fluoro-1-propan-2-ylbenzimidazole has a molecular weight of 178.21 g/mol, XLogP of 2.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-propan-2-ylbenzimidazole is sourced from PubChem (CID 141105255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).